data_2myj_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 2myj _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 . . . . . 0 CA--C 1.542 0.638 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.973 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.2 t 97.07 93.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 128.885 2.874 . . . . 0.0 117.422 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.53 -33.64 70.09 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 119.921 -1.737 . . . . 0.0 112.345 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.472 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 1.1 ptpt -73.85 -9.87 59.08 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 176.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -113.9 5.06 16.07 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.92 1.288 . . . . 0.0 112.468 168.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 29.0 ttm -60.57 127.31 31.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.957 1.253 . . . . 0.0 109.482 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -78.99 155.89 28.68 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.33 -35.75 78.26 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 120.338 -1.476 . . . . 0.0 112.801 -175.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -61.69 -32.47 72.67 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.668 0.787 . . . . 0.0 113.014 172.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -80.57 -36.84 32.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.115 1.366 . . . . 0.0 111.56 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.11 -48.57 81.13 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.532 -0.73 . . . . 0.0 112.327 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.2 pt -70.41 -2.04 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 124.318 1.047 . . . . 0.0 112.809 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -113.46 -15.08 12.66 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.973 1.709 . . . . 0.0 114.281 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 161.81 20.5 Favored 'General case' 0 CA--C 1.558 1.251 0 O-C-N 120.981 -1.074 . . . . 0.0 110.498 169.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -63.92 132.53 95.28 Favored Pre-proline 0 N--CA 1.483 1.189 0 O-C-N 120.894 -1.129 . . . . 0.0 112.011 -176.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -62.22 -16.94 54.15 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.332 2.688 . . . . 0.0 114.831 -178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mptt -57.87 -62.81 1.54 Allowed 'General case' 0 C--N 1.351 0.657 0 C-N-CA 125.218 1.407 . . . . 0.0 108.829 167.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.56 -10.48 59.52 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 89.0 mtp -60.21 -37.68 81.02 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 120.905 -1.122 . . . . 0.0 112.937 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.4 m -61.22 -52.09 73.68 Favored Pre-proline 0 N--CA 1.485 1.295 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -59.7 -41.79 52.34 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.772 2.315 . . . . 0.0 113.285 169.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 87.9 t -56.73 -42.18 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 120.904 -1.123 . . . . 0.0 111.725 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.17 82.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.821 0.848 . . . . 0.0 111.556 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.14 -36.69 58.68 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.882 1.219 . . . . 0.0 111.351 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.495 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -52.13 -41.95 62.95 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.976 1.262 . . . . 0.0 112.254 176.111 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -72.98 -53.31 11.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.795 1.638 . . . . 0.0 111.805 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 123.49 0.716 . . . . 0.0 112.237 -169.788 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 N--CA 1.464 0.246 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.23 -34.6 72.4 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.563 1.145 . . . . 0.0 111.904 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 98.4 m -71.98 -36.2 69.74 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.762 0.825 . . . . 0.0 111.189 174.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -79.49 -24.86 42.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.519 -178.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.77 -46.1 98.53 Favored Pre-proline 0 N--CA 1.481 1.092 0 CA-C-N 120.824 1.647 . . . . 0.0 112.535 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.25 -37.6 10.16 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.808 1.672 . . . . 0.0 113.3 170.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -66.08 -34.9 79.12 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.704 -1.247 . . . . 0.0 113.391 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.6 m -68.96 -17.17 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 118.965 0.802 . . . . 0.0 113.16 175.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -88.42 -52.44 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.369 1.068 . . . . 0.0 110.367 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -55.7 -47.82 76.17 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.292 1.037 . . . . 0.0 110.621 177.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -63.54 -25.24 68.16 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.43 -0.794 . . . . 0.0 112.106 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.17 -49.03 13.21 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.484 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.01 68.62 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 120.961 1.71 . . . . 0.0 113.966 174.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -71.22 -28.32 64.11 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 114.392 169.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.4 m-80 -135.37 66.57 65.89 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.982 1.313 . . . . 0.0 112.383 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -57.59 -15.68 21.28 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.591 2.861 . . . . 0.0 116.575 -173.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -82.6 -21.3 35.22 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.298 1.439 . . . . 0.0 113.523 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -71.62 160.37 32.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.694 1.197 . . . . 0.0 111.933 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -76.56 154.7 34.26 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.854 -0.529 . . . . 0.0 109.891 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -70.18 -38.42 75.37 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.264 -0.898 . . . . 0.0 113.103 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.472 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 1.4 m-85 -82.58 -21.96 35.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.0 t -60.11 -20.76 59.86 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.377 -0.827 . . . . 0.0 111.961 173.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -62.03 -5.07 1.93 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.586 -1.946 . . . . 0.0 114.074 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -33.77 74.13 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 119.806 1.184 . . . . 0.0 111.518 165.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -62.13 -31.93 72.46 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -167.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -74.78 -28.01 60.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.774 1.63 . . . . 0.0 115.129 176.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -166.281 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 103.69 -2.707 . . . . 0.0 103.69 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m -87.57 87.91 7.52 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 125.298 1.439 . . . . 0.0 113.285 -165.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.88 -38.57 56.59 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 120.383 1.447 . . . . 0.0 110.463 170.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -67.8 -7.03 24.28 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 127.686 2.394 . . . . 0.0 115.707 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -136.59 18.85 3.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.91 1.284 . . . . 0.0 112.482 174.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.9 ttm -59.48 120.92 10.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 168.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.0 t -73.77 153.79 39.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.107 -0.995 . . . . 0.0 109.552 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.71 -31.24 72.11 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.55 -1.344 . . . . 0.0 113.235 -172.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -65.84 -32.43 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.198 0.908 . . . . 0.0 113.121 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -76.5 -36.6 57.69 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.292 1.437 . . . . 0.0 111.115 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -63.79 -48.64 76.07 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.29 -0.881 . . . . 0.0 112.932 177.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.0 pt -69.63 -5.16 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 123.345 0.658 . . . . 0.0 112.697 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -103.47 -15.46 15.87 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.221 1.808 . . . . 0.0 114.23 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 158.86 31.72 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.9 1.227 . . . . 0.0 110.581 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -66.4 132.05 94.29 Favored Pre-proline 0 N--CA 1.481 1.092 0 O-C-N 121.416 -0.802 . . . . 0.0 111.6 -174.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -56.95 -20.46 36.69 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.81 3.007 . . . . 0.0 115.379 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -56.7 -64.12 0.98 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.996 1.719 . . . . 0.0 108.89 166.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.34 -12.15 59.1 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.0 ttm -57.02 -35.87 69.77 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.511 -1.368 . . . . 0.0 111.916 172.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.4 m -63.0 -54.92 42.25 Favored Pre-proline 0 N--CA 1.482 1.155 0 C-N-CA 124.319 1.047 . . . . 0.0 112.81 -177.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -50.1 -45.94 30.74 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.5 2.8 . . . . 0.0 113.685 168.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.64 -38.51 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.003 0.82 . . . . 0.0 111.838 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.63 90.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.576 0.751 . . . . 0.0 111.297 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CG ' ' CH2' ' A' ' 27' ' ' TRP . 89.5 t90 -67.35 -46.79 72.35 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.59 1.086 . . . . 0.0 110.243 167.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -58.34 -33.28 69.36 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 123.427 1.584 . . . . 0.0 113.073 -168.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.3 tmm? -76.05 -42.59 47.11 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.234 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 CA--C 1.55 0.954 0 O-C-N 120.849 -1.157 . . . . 0.0 114.063 171.934 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.57 -30.06 64.94 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.183 -0.948 . . . . 0.0 112.706 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 68.0 m -80.39 -34.47 36.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.952 0.901 . . . . 0.0 111.949 174.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -79.63 -36.84 37.28 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 117.869 -1.062 . . . . 0.0 113.527 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -48.96 -46.3 74.68 Favored Pre-proline 0 N--CA 1.478 0.929 0 CA-C-N 120.238 1.381 . . . . 0.0 113.017 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.6 -38.21 6.24 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 CA-C-N 122.074 1.777 . . . . 0.0 113.448 171.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -64.81 -34.4 78.27 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.913 1.233 . . . . 0.0 113.367 -175.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 20.8 m -75.48 -27.86 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.217 0.607 . . . . 0.0 112.575 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.9 mt -67.8 -47.24 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.09 -38.82 80.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.887 0.875 . . . . 0.0 112.316 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.49 -31.88 73.19 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.181 0.901 . . . . 0.0 112.149 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -72.14 -48.01 46.77 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.802 -1.186 . . . . 0.0 112.397 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -29.4 68.54 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.181 1.355 . . . . 0.0 114.502 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -79.32 -22.08 45.04 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 171.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.47 64.89 66.12 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 126.66 1.984 . . . . 0.0 110.45 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -64.22 -11.49 28.11 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.988 3.125 . . . . 0.0 115.881 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -81.42 -21.26 39.02 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.705 1.202 . . . . 0.0 113.387 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -68.03 159.03 31.6 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.838 0.855 . . . . 0.0 112.373 -173.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -83.9 127.91 34.18 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.7 tp -44.73 -38.86 4.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.03 -7.59 58.23 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 57.4 p -60.43 -30.15 69.45 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 120.579 -1.325 . . . . 0.0 111.125 167.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -69.54 -2.45 11.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.774 1.63 . . . . 0.0 113.533 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -38.38 53.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.159 0.983 . . . . 0.0 110.896 166.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -29.97 71.02 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -167.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -68.68 -27.78 66.28 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.661 1.984 . . . . 0.0 115.646 170.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.745 0 C-N-CA 125.11 1.364 . . . . 0.0 114.214 -167.537 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 . . . . . 0 N--CA 1.444 -0.744 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.0 t -102.75 92.93 4.82 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.895 1.278 . . . . 0.0 113.065 -165.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.58 68.45 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.418 -1.426 . . . . 0.0 111.329 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.459 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 5.6 ptpt -74.41 -7.22 52.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.241 1.816 . . . . 0.0 115.228 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -123.41 15.81 9.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.404 1.482 . . . . 0.0 111.95 168.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.1 ttm -61.86 118.63 7.46 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.829 -1.169 . . . . 0.0 108.446 171.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -76.64 155.35 33.51 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.059 -1.026 . . . . 0.0 109.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.84 -29.72 69.71 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 120.312 -1.492 . . . . 0.0 113.784 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -40.74 96.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.114 0.87 . . . . 0.0 111.804 169.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -66.86 -37.02 83.65 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.772 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -60.91 -52.99 62.68 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.39 -0.819 . . . . 0.0 112.299 177.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.04 -0.93 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.103 1.361 . . . . 0.0 112.785 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -107.16 -15.59 14.63 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.427 1.491 . . . . 0.0 113.61 172.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.38 164.56 22.67 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.076 -1.015 . . . . 0.0 110.522 169.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -71.73 131.37 86.05 Favored Pre-proline 0 N--CA 1.484 1.233 0 O-C-N 120.867 -1.145 . . . . 0.0 112.411 -176.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -18.37 23.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.557 3.505 . . . . 0.0 116.299 175.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -60.36 -58.19 9.55 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.304 1.842 . . . . 0.0 109.212 167.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.46 -2.68 58.78 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 75.4 mtp -63.18 -36.65 84.33 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.43 -1.419 . . . . 0.0 111.509 169.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.7 m -59.81 -52.25 75.08 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 124.776 1.231 . . . . 0.0 113.362 -177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.402 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 8.3 Cg_endo -53.19 -58.58 1.38 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.165 2.576 . . . . 0.0 113.94 167.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.4 p -63.48 -25.26 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 120.893 1.679 . . . . 0.0 113.294 -169.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.37 67.94 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 118.124 -0.941 . . . . 0.0 113.21 171.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 62.6 t90 -84.03 -55.34 4.27 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.176 1.353 . . . . 0.0 114.303 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.453 ' CD1' ' N ' ' A' ' 27' ' ' TRP . 4.7 m95 -51.68 -40.28 59.79 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.886 0.85 . . . . 0.0 110.888 -173.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -58.57 -49.38 77.65 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.941 1.697 . . . . 0.0 111.934 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 C-N-CA 124.976 1.311 . . . . 0.0 113.755 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.468 0.45 0 CA-C-O 119.555 -0.259 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.47 -28.38 69.17 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.179 -0.951 . . . . 0.0 112.127 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 96.8 m -74.47 -38.41 62.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.39 0.676 . . . . 0.0 111.06 172.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -83.17 -32.21 26.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.121 -1.419 . . . . 0.0 114.033 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -46.64 -48.62 48.64 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-N 120.626 1.557 . . . . 0.0 112.77 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -36.3 30.01 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.376 2.051 . . . . 0.0 113.949 172.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -64.11 -34.19 77.47 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.833 -1.167 . . . . 0.0 112.977 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.09 -30.4 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.61 0.641 . . . . 0.0 111.692 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 mt -78.62 -51.17 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.506 0.722 . . . . 0.0 110.585 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.49 -39.3 87.2 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.646 0.778 . . . . 0.0 112.075 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -68.73 -31.05 69.84 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.305 0.642 . . . . 0.0 111.293 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.4 m -73.43 -46.04 50.86 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.086 -1.009 . . . . 0.0 113.223 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.42 68.77 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 121.032 1.742 . . . . 0.0 114.235 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -76.88 -33.79 57.81 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 174.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -132.4 77.56 69.96 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.631 1.172 . . . . 0.0 112.019 172.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -54.13 -11.78 3.07 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 124.972 3.781 . . . . 0.0 117.255 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -27.23 56.75 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.22 1.408 . . . . 0.0 112.527 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt -65.97 157.51 30.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.798 1.239 . . . . 0.0 112.493 -174.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -93.05 133.89 35.74 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 169.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.6 tp -49.81 -32.87 15.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.448 1.499 . . . . 0.0 114.175 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.459 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.1 m-85 -82.8 -10.76 58.72 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.2 p -60.61 -25.79 66.53 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.698 -1.252 . . . . 0.0 111.573 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -72.73 -0.08 12.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.723 1.609 . . . . 0.0 113.944 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.36 -34.18 25.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.649 1.579 . . . . 0.0 111.48 167.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -70.18 -28.8 65.6 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.045 1.338 . . . . 0.0 111.933 -170.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -71.88 -30.28 65.24 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.49 1.516 . . . . 0.0 115.008 175.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.568 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -166.294 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 97.63 99.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.891 2.876 . . . . 0.0 116.156 168.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.33 -30.9 67.06 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 120.083 -1.636 . . . . 0.0 111.774 169.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -67.08 -17.85 65.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.085 1.754 . . . . 0.0 115.292 174.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.57 6.29 14.57 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.596 1.158 . . . . 0.0 113.175 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.3 ttm -63.21 125.71 24.99 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.96 -1.087 . . . . 0.0 110.651 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -79.87 155.48 27.78 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.834 -1.166 . . . . 0.0 110.866 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.08 -35.36 78.43 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.116 -1.615 . . . . 0.0 112.862 -174.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.31 -29.42 70.5 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.182 0.901 . . . . 0.0 112.731 173.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -82.45 -35.58 27.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.719 1.608 . . . . 0.0 111.386 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -63.35 -48.55 77.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.789 0.835 . . . . 0.0 112.727 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -67.75 -4.52 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.785 0.834 . . . . 0.0 112.854 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.28 -11.03 15.66 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.487 1.915 . . . . 0.0 114.404 172.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 158.26 36.01 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.653 -1.279 . . . . 0.0 110.83 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -65.41 129.98 94.55 Favored Pre-proline 0 N--CA 1.478 0.941 0 O-C-N 121.207 -0.933 . . . . 0.0 111.534 -178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.75 -18.08 53.78 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.935 2.423 . . . . 0.0 114.808 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -54.5 -66.95 0.31 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.217 1.407 . . . . 0.0 109.521 168.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.55 -9.84 59.69 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.8 ttm -56.26 -43.44 78.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.871 0.868 . . . . 0.0 112.581 171.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 86.6 m -55.85 -54.73 48.75 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.019 -0.991 . . . . 0.0 113.655 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -54.4 -54.2 5.01 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 124.438 3.425 . . . . 0.0 114.073 169.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.13 -31.39 52.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 119.667 -1.896 . . . . 0.0 113.338 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.27 71.16 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.399 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -86.83 -41.1 14.32 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 116.402 -1.761 . . . . 0.0 111.593 175.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.421 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 6.2 m0 -59.74 -22.95 62.77 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 123.356 2.798 . . . . 0.0 113.659 171.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.9 tmm? -76.97 -63.99 1.23 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.43 0.692 . . . . 0.0 111.092 167.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 C-N-CA 124.639 1.176 . . . . 0.0 113.842 -168.733 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 N--CA 1.47 0.544 0 CA-C-O 120.033 -0.032 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 92.0 mt -57.28 -28.35 62.92 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.523 0.729 . . . . 0.0 112.48 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 53.3 m -83.94 -34.69 24.41 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.607 1.163 . . . . 0.0 112.406 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -84.67 -33.34 23.23 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 117.608 -1.187 . . . . 0.0 113.751 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.33 -43.86 92.15 Favored Pre-proline 0 N--CA 1.481 1.11 0 CA-C-N 120.457 1.48 . . . . 0.0 112.871 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.46 -39.07 7.55 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 CA-C-N 122.389 1.889 . . . . 0.0 113.312 171.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.24 -33.91 77.1 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.776 1.171 . . . . 0.0 113.76 -174.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.32 -24.07 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.358 0.663 . . . . 0.0 112.355 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 27.5 mt -73.95 -49.78 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.607 0.763 . . . . 0.0 109.567 170.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -58.51 -41.56 85.7 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.957 0.903 . . . . 0.0 112.258 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.79 -26.16 65.96 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.167 -0.958 . . . . 0.0 112.302 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.2 -47.15 25.09 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.766 0.827 . . . . 0.0 112.215 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -26.86 68.14 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 120.268 1.394 . . . . 0.0 114.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.258 15.1 ptpt -84.13 -10.15 58.01 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -137.56 61.35 30.42 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 111.112 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.65 -14.16 34.19 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.877 3.051 . . . . 0.0 115.679 -168.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -85.57 -14.99 44.07 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 113.657 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -74.43 158.5 33.76 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.199 0.999 . . . . 0.0 111.765 -172.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -92.86 133.7 35.81 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.23 -40.05 46.42 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.914 1.285 . . . . 0.0 114.272 -169.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.257 5.0 m-85 -79.2 -6.84 57.53 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.9 p -61.97 -27.12 68.63 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.694 -1.254 . . . . 0.0 111.176 168.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -72.58 -3.66 26.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.04 1.336 . . . . 0.0 113.943 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -81.38 -29.46 34.01 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.374 0.988 . . . . 0.0 112.036 167.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -68.97 -32.12 71.47 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.747 0.819 . . . . 0.0 112.049 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -69.67 -28.43 65.86 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.16 1.784 . . . . 0.0 115.376 169.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -165.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -134.48 56.76 1.83 Allowed 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 123.675 0.79 . . . . 0.0 110.248 169.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -52.76 -40.97 63.6 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 121.273 1.851 . . . . 0.0 111.475 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.408 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 3.3 ptpt -64.53 -11.04 30.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.511 2.324 . . . . 0.0 116.172 175.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -133.28 21.0 4.02 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.036 1.735 . . . . 0.0 111.727 171.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.3 ttm -62.13 122.65 16.08 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 177.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.6 t -76.96 153.97 34.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.08 -32.61 74.03 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 120.616 -1.302 . . . . 0.0 112.823 -173.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -62.96 -31.13 72.17 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.712 0.805 . . . . 0.0 112.971 170.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.73 -39.41 27.04 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.41 1.484 . . . . 0.0 111.851 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -58.71 -49.76 76.42 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.476 -0.765 . . . . 0.0 113.028 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -67.25 -4.44 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 C-N-CA 123.979 0.912 . . . . 0.0 112.668 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -112.94 -5.48 13.81 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.227 1.811 . . . . 0.0 113.813 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.81 161.98 28.55 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.897 -1.127 . . . . 0.0 110.382 173.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -66.41 128.19 93.71 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 120.899 -1.126 . . . . 0.0 111.611 -174.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.4 -20.81 16.32 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.339 3.359 . . . . 0.0 115.879 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -59.86 -67.07 0.42 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.181 1.792 . . . . 0.0 109.811 168.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.16 -5.29 57.53 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -177.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -60.79 -40.38 92.44 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.1 -1.0 . . . . 0.0 112.674 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.253 23.7 m -65.4 -52.11 47.79 Favored Pre-proline 0 N--CA 1.479 0.993 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -177.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.69 -42.85 42.19 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.558 2.839 . . . . 0.0 116.146 169.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.33 -37.44 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 119.913 1.233 . . . . 0.0 113.087 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.83 -28.62 68.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.781 0.832 . . . . 0.0 111.738 171.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.8 t90 -81.83 -53.77 5.91 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 117.693 -1.146 . . . . 0.0 112.406 170.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.43 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.0 t90 -64.12 -37.81 88.78 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 120.365 1.439 . . . . 0.0 111.281 -167.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -59.08 -31.23 68.71 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.746 1.218 . . . . 0.0 112.615 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 71.6 mt -64.63 -28.58 69.72 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.118 -0.989 . . . . 0.0 112.369 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 93.6 m -71.8 -41.68 67.98 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.534 0.734 . . . . 0.0 110.841 169.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -75.95 -33.32 59.8 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -175.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.253 1.6 mp -54.21 -41.94 91.27 Favored Pre-proline 0 CA--C 1.554 1.116 0 CA-C-N 119.694 1.134 . . . . 0.0 112.654 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.95 -36.81 5.57 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.193 1.929 . . . . 0.0 113.823 169.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -64.17 -33.43 75.77 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.16 1.345 . . . . 0.0 113.74 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.37 -23.53 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 118.773 0.715 . . . . 0.0 112.809 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.2 mt -80.02 -52.2 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.165 0.986 . . . . 0.0 110.189 173.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -54.33 -51.77 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.817 0.847 . . . . 0.0 110.489 175.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -64.73 -25.6 68.0 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.434 -0.791 . . . . 0.0 112.31 -178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.83 -48.78 14.1 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.996 -1.002 . . . . 0.0 113.134 172.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -27.58 69.08 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 121.485 1.948 . . . . 0.0 113.851 174.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -70.22 -29.17 65.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.829 1.651 . . . . 0.0 114.032 168.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -133.91 69.91 74.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.706 1.202 . . . . 0.0 112.304 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -55.41 -16.57 14.13 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.232 2.621 . . . . 0.0 116.356 -176.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -85.65 -27.03 25.66 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -64.33 161.3 17.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.156 0.982 . . . . 0.0 112.661 -175.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -81.22 142.0 33.61 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.856 -0.527 . . . . 0.0 110.1 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.87 -35.81 69.33 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.018 0.927 . . . . 0.0 113.34 171.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.408 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -84.85 -28.25 26.18 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -171.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.2 t -62.48 -17.35 59.35 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.132 -0.98 . . . . 0.0 112.085 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -62.66 -6.63 3.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 119.722 -1.861 . . . . 0.0 113.929 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.09 72.5 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.239 1.416 . . . . 0.0 111.665 167.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -30.77 67.46 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -167.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -73.3 -30.16 63.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.814 1.246 . . . . 0.0 113.854 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.29 0 C-N-CA 124.449 1.1 . . . . 0.0 112.183 -167.68 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -92.97 95.59 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.752 -1.218 . . . . 0.0 113.786 -166.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.88 -36.77 59.61 Favored 'General case' 0 CA--C 1.558 1.277 0 O-C-N 121.16 -0.962 . . . . 0.0 109.932 168.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.405 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 25.2 mtmt -67.99 -12.71 61.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 128.89 2.876 . . . . 0.0 116.284 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -133.21 19.04 4.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.5 ttm -59.78 123.85 18.27 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 169.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -78.04 154.64 31.23 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.34 -0.85 . . . . 0.0 110.327 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.0 m -61.45 -35.09 76.63 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 120.482 -1.386 . . . . 0.0 112.596 -173.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -65.64 -32.33 73.85 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.306 0.957 . . . . 0.0 112.725 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -76.23 -37.83 57.18 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.03 1.332 . . . . 0.0 111.344 174.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -63.95 -49.43 72.6 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.944 0.898 . . . . 0.0 112.614 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.19 -2.99 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -110.79 -8.59 14.53 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.606 1.962 . . . . 0.0 114.089 172.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.6 156.89 35.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.747 1.158 . . . . 0.0 110.177 172.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -66.43 127.53 93.37 Favored Pre-proline 0 N--CA 1.479 0.986 0 O-C-N 121.3 -0.875 . . . . 0.0 109.662 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -46.77 -32.18 11.82 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.683 2.922 . . . . 0.0 113.819 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -60.11 -13.82 13.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -132.94 22.59 4.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 121.421 1.919 . . . . 0.0 113.123 165.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ttm -67.57 -54.77 17.11 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.677 1.191 . . . . 0.0 111.295 170.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.0 m -48.09 -55.7 17.04 Favored Pre-proline 0 N--CA 1.49 1.54 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.68 -45.42 40.49 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.124 3.216 . . . . 0.0 115.543 174.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.32 -39.99 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.391 1.451 . . . . 0.0 112.935 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.23 -31.86 71.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.185 0.594 . . . . 0.0 110.68 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 67.3 t90 -78.78 -48.61 14.49 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.541 172.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.41 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.7 t90 -64.67 -25.88 68.14 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 117.888 -1.525 . . . . 0.0 110.957 -171.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -62.0 -60.38 3.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.118 1.367 . . . . 0.0 111.17 167.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.67 0 C-N-CA 125.143 1.377 . . . . 0.0 113.423 -170.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.02 -30.44 61.88 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.1 m -81.91 -33.87 30.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.811 0.845 . . . . 0.0 112.347 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -83.17 -31.94 26.86 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.766 -1.112 . . . . 0.0 113.76 -177.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.82 -47.03 86.92 Favored Pre-proline 0 N--CA 1.481 1.1 0 CA-C-N 120.433 1.47 . . . . 0.0 113.038 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.31 -37.64 17.37 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 122.208 1.824 . . . . 0.0 113.318 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -65.42 -36.83 85.11 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.776 -1.203 . . . . 0.0 113.152 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 m -73.25 -28.44 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.777 -0.577 . . . . 0.0 112.49 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 49.7 mt -66.17 -49.23 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-N 118.191 0.45 . . . . 0.0 109.894 170.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.31 -41.61 80.24 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.406 0.683 . . . . 0.0 111.904 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -66.6 -27.53 67.78 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.517 -0.74 . . . . 0.0 112.923 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -76.07 -48.36 21.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.846 0.858 . . . . 0.0 112.184 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -26.47 68.28 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.979 1.263 . . . . 0.0 114.294 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.279 15.2 ptpt -83.73 -10.45 58.12 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 169.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -138.32 61.73 27.35 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.655 1.582 . . . . 0.0 111.439 174.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.81 -14.63 33.16 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.801 3.001 . . . . 0.0 115.847 -169.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -84.99 -14.54 47.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 113.681 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -77.33 160.09 29.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.681 1.192 . . . . 0.0 112.147 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -77.84 139.83 39.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.551 -0.718 . . . . 0.0 109.3 169.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -54.18 -35.76 62.66 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.089 0.956 . . . . 0.0 112.875 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.405 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -87.16 -23.03 24.96 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -170.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.1 t -64.24 -14.61 56.72 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 120.771 -1.206 . . . . 0.0 112.018 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -66.06 -5.17 8.87 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.487 -2.008 . . . . 0.0 114.18 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.01 -30.05 49.84 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 119.929 1.241 . . . . 0.0 111.565 166.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -64.98 -33.68 76.61 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.921 1.289 . . . . 0.0 112.037 -171.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -73.07 -28.8 62.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.528 1.931 . . . . 0.0 115.647 173.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -166.255 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.48 ' HB3' ' HE3' ' B' ' 98' ' ' LYS . 20.2 mm-40 . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 117.923 -1.037 . . . . 0.0 113.164 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 101.92 100.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 129.462 3.105 . . . . 0.0 114.919 168.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.73 -33.55 73.07 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.313 -1.492 . . . . 0.0 112.588 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.3 ptpt -74.31 -12.46 60.55 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -106.02 6.08 30.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.452 1.101 . . . . 0.0 112.594 168.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 43.0 ttm -62.02 129.31 40.3 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.724 -1.235 . . . . 0.0 109.722 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.88 155.12 27.92 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.049 -1.032 . . . . 0.0 110.481 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.88 -32.61 74.19 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.264 -1.522 . . . . 0.0 113.417 -175.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.86 -31.47 71.74 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -81.22 -35.0 31.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.39 1.476 . . . . 0.0 111.53 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -57.94 -50.45 73.31 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 121.562 -0.711 . . . . 0.0 112.658 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -69.57 -0.66 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 125.262 1.425 . . . . 0.0 113.042 177.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -111.54 -11.28 14.08 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.351 1.46 . . . . 0.0 114.318 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.42 165.99 24.04 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.188 -0.945 . . . . 0.0 111.622 174.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -65.74 128.72 94.02 Favored Pre-proline 0 N--CA 1.483 1.191 0 O-C-N 120.941 -1.099 . . . . 0.0 112.542 -177.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -57.65 -12.74 12.15 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.556 3.504 . . . . 0.0 116.521 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 9.3 mttt -65.75 -67.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.029 1.731 . . . . 0.0 109.672 166.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.64 -6.47 52.18 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 73.6 mtp -57.06 -30.74 64.53 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 121.009 -1.057 . . . . 0.0 112.155 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.267 23.7 m -68.15 -56.1 11.62 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.67 -36.62 82.09 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 123.173 2.582 . . . . 0.0 114.768 168.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 66.2 t -63.74 -53.97 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.504 0.593 . . . . 0.0 111.067 175.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.3 71.37 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.786 1.235 . . . . 0.0 111.685 -177.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.0 t90 -77.68 -52.74 8.49 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 117.575 -1.203 . . . . 0.0 113.459 169.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.494 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 3.0 t90 -66.44 -34.22 77.45 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.761 1.619 . . . . 0.0 111.886 -167.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 58.0 ttp -54.3 -44.2 71.78 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.958 0.903 . . . . 0.0 112.115 169.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.556 0 C-N-CA 125.281 1.432 . . . . 0.0 112.909 -171.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 CA--C 1.533 0.323 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.5 mt -64.24 -25.24 67.97 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.892 -1.13 . . . . 0.0 112.219 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.8 m -77.83 -35.49 51.11 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.701 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -88.49 -27.81 21.23 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.06 -43.64 85.18 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.913 174.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.69 -40.36 10.13 Favored 'Trans proline' 0 C--N 1.352 0.726 0 CA-C-N 122.16 1.807 . . . . 0.0 113.572 169.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -63.35 -37.23 86.48 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.954 1.252 . . . . 0.0 112.928 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 m -68.97 -28.38 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -72.31 -51.43 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 173.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.99 -43.09 77.31 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.141 0.977 . . . . 0.0 111.415 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.29 -30.49 69.51 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.831 -0.543 . . . . 0.0 111.375 -177.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.77 -42.7 57.67 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.11 -0.994 . . . . 0.0 112.807 174.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -31.08 68.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.764 1.62 . . . . 0.0 114.284 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -82.6 -25.71 32.97 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -130.9 73.95 80.5 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.767 1.627 . . . . 0.0 110.603 170.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.52 -11.45 16.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.731 3.621 . . . . 0.0 115.722 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -81.92 -25.14 35.18 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.806 1.642 . . . . 0.0 112.613 -175.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -66.41 154.61 39.69 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.114 0.966 . . . . 0.0 111.395 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -89.62 127.42 35.9 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 174.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.26 -51.5 10.77 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -166.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.443 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -70.92 -6.74 40.75 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.5 p -56.74 -28.21 60.69 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 120.75 -1.219 . . . . 0.0 110.969 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -71.16 -2.26 15.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.515 1.526 . . . . 0.0 114.307 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -83.41 -31.08 26.85 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 111.811 167.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -69.5 -28.69 66.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 111.94 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -75.63 -31.53 59.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.624 1.57 . . . . 0.0 114.988 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 112.425 -166.858 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.409 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 20.8 mm-40 . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m 117.99 78.91 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 130.885 3.674 . . . . 0.0 112.665 170.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.4 -39.37 70.11 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.156 -1.59 . . . . 0.0 111.905 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.454 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 2.3 ptpt -78.82 3.63 16.24 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -124.97 9.88 8.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.8 1.24 . . . . 0.0 112.2 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 37.6 ttm -61.5 124.7 21.37 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.476 1.034 . . . . 0.0 109.427 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -76.69 153.24 35.31 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.757 -0.589 . . . . 0.0 110.008 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.93 -28.27 68.16 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.323 -1.486 . . . . 0.0 113.88 -170.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -67.23 -31.85 72.48 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 118.806 0.73 . . . . 0.0 112.551 169.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -75.71 -37.96 59.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.004 1.322 . . . . 0.0 111.28 176.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -67.85 -4.83 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.99 -10.34 17.29 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.957 1.703 . . . . 0.0 113.886 172.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.67 157.77 37.4 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.81 1.187 . . . . 0.0 111.199 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.64 134.75 89.23 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 123.603 0.761 . . . . 0.0 113.036 -178.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -72.59 -7.19 20.42 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.719 1.612 . . . . 0.0 115.947 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . 0.48 ' HE3' ' HB3' ' A' ' 3' ' ' GLU . 6.3 mptt -71.3 -53.79 13.05 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.926 1.694 . . . . 0.0 108.712 167.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.32 -15.6 54.92 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 36.3 ttm -54.03 -33.33 57.01 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.636 -0.665 . . . . 0.0 112.6 172.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 30.9 m -65.4 -58.24 12.59 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.773 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -51.79 -41.98 59.64 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 124.053 3.168 . . . . 0.0 115.033 172.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.92 -42.49 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.637 1.108 . . . . 0.0 113.034 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.69 -29.08 69.85 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.2 t90 -77.56 -51.9 9.93 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 117.728 -1.13 . . . . 0.0 112.16 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -65.84 -29.24 69.67 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.801 1.637 . . . . 0.0 111.21 -169.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 2.8 ttp -65.82 -39.25 90.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.726 1.61 . . . . 0.0 111.895 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 124.543 1.137 . . . . 0.0 112.43 -177.83 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 22.0 t70 . . . . . 0 CA--C 1.539 0.556 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 pp -62.05 -27.27 68.78 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 21.8 m -81.28 -31.49 33.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 122.502 0.321 . . . . 0.0 111.504 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -84.06 -26.1 29.31 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.389 -1.291 . . . . 0.0 114.472 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.16 -42.28 79.81 Favored Pre-proline 0 N--CA 1.482 1.15 0 CA-C-N 121.533 1.969 . . . . 0.0 113.983 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.44 -36.02 5.71 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 CA-C-N 122.487 1.924 . . . . 0.0 113.255 169.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -67.88 -30.78 70.23 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.697 -1.252 . . . . 0.0 113.923 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.0 m -70.9 -31.21 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.989 0.813 . . . . 0.0 111.431 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -68.15 -50.66 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 109.864 171.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -55.19 -44.65 75.48 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.852 0.861 . . . . 0.0 111.571 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.17 -37.03 84.64 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.458 1.026 . . . . 0.0 111.888 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.9 -36.66 78.31 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.456 -0.777 . . . . 0.0 112.189 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -58.3 -51.21 70.73 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.43 1.492 . . . . 0.0 112.648 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 pttt -84.87 -21.58 29.71 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -128.92 76.87 78.65 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.896 1.679 . . . . 0.0 109.672 170.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.09 -9.69 22.72 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.895 3.064 . . . . 0.0 114.957 -176.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -81.96 -21.44 37.2 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.312 1.445 . . . . 0.0 112.833 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -70.37 159.65 33.75 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.441 1.097 . . . . 0.0 111.992 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -92.66 130.26 38.35 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 169.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 65.6 tp -45.33 -47.41 13.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.999 1.32 . . . . 0.0 114.244 -172.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.454 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -72.53 -8.76 56.79 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -174.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 70.3 p -60.53 -24.53 65.44 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.677 -1.264 . . . . 0.0 111.61 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -72.43 -1.18 14.7 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.831 1.253 . . . . 0.0 114.26 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -80.73 -31.85 35.89 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.663 1.12 . . . . 0.0 111.572 165.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -68.75 -29.05 67.37 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.709 1.204 . . . . 0.0 112.465 -169.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.94 -30.01 68.37 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 114.115 169.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.566 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -168.935 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 . . . . . 0 CA--C 1.544 0.729 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.5 m 90.69 99.76 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 129.685 3.194 . . . . 0.0 117.808 165.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.99 -32.4 66.06 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 119.87 -1.769 . . . . 0.0 111.861 169.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.406 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 32.0 mttt -58.92 -22.81 60.44 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 126.989 2.116 . . . . 0.0 114.86 175.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -119.29 6.01 11.2 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.895 1.678 . . . . 0.0 112.756 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -61.84 127.41 31.27 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.924 -1.11 . . . . 0.0 109.755 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.58 155.19 28.26 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.292 -0.88 . . . . 0.0 110.022 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.39 -33.84 76.43 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 120.454 -1.404 . . . . 0.0 113.187 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -64.09 -32.24 73.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.774 0.716 . . . . 0.0 112.881 172.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -77.22 -38.18 51.79 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.885 1.274 . . . . 0.0 111.836 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -59.09 -50.37 74.31 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.818 0.847 . . . . 0.0 112.438 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.1 pt -68.36 -5.07 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 124.454 1.102 . . . . 0.0 112.925 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -105.75 -8.98 17.5 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.735 1.614 . . . . 0.0 113.543 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.14 157.89 33.94 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 119.758 1.163 . . . . 0.0 110.462 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -66.83 129.74 94.03 Favored Pre-proline 0 N--CA 1.482 1.132 0 O-C-N 121.216 -0.927 . . . . 0.0 111.426 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -52.17 -27.82 31.18 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.385 2.723 . . . . 0.0 115.019 177.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -51.32 -66.5 0.37 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.769 1.628 . . . . 0.0 111.078 170.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.255 . . -83.07 -4.55 58.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 178.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.2 ttt -64.65 -36.55 84.61 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.857 -1.152 . . . . 0.0 112.211 168.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.9 m -60.45 -51.83 77.22 Favored Pre-proline 0 N--CA 1.478 0.939 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.43 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 10.0 Cg_endo -54.94 -46.3 34.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.16 2.573 . . . . 0.0 115.309 169.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.96 -35.52 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 119.765 1.166 . . . . 0.0 113.154 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.12 -18.34 64.33 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.45 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.2 t90 -95.69 -48.6 5.72 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.181 0.901 . . . . 0.0 111.665 168.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.512 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 56.6 t-105 -64.24 -34.58 78.43 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.563 1.145 . . . . 0.0 111.922 -170.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.2 tmm? -67.18 -46.78 72.93 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 124.831 1.252 . . . . 0.0 111.385 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 124.775 1.23 . . . . 0.0 112.749 -169.288 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.1 -27.37 69.35 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.056 -1.027 . . . . 0.0 112.436 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.0 m -76.39 -35.39 58.65 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.405 1.082 . . . . 0.0 111.615 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.53 -28.17 31.21 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.453 1.024 . . . . 0.0 113.642 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.256 1.5 mp -52.93 -40.68 80.45 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.301 1.41 . . . . 0.0 113.628 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.44 -37.01 3.47 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 122.225 1.83 . . . . 0.0 113.175 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -64.57 -34.3 77.94 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.302 -1.499 . . . . 0.0 113.65 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.74 -15.85 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 174.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.0 mt -91.38 -51.27 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.456 1.102 . . . . 0.0 110.663 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.5 -48.39 71.92 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.942 0.897 . . . . 0.0 110.321 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -65.26 -23.57 67.08 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.282 -0.886 . . . . 0.0 112.62 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.7 -48.42 13.7 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.309 0.959 . . . . 0.0 112.668 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.8 -27.17 69.0 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 120.851 1.66 . . . . 0.0 113.892 174.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -72.5 -31.0 65.01 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.67 1.588 . . . . 0.0 114.884 169.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -130.81 64.52 73.84 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.173 1.389 . . . . 0.0 111.369 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -59.51 -14.87 27.54 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 124.267 3.311 . . . . 0.0 115.726 -172.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -84.61 -20.85 30.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.604 1.562 . . . . 0.0 113.797 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -73.46 162.27 29.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.993 1.317 . . . . 0.0 112.248 -172.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -77.68 154.1 32.45 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.923 -0.486 . . . . 0.0 110.04 169.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.36 -36.7 77.1 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.28 -0.887 . . . . 0.0 113.382 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.406 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.3 m-85 -88.05 -21.09 24.95 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 -168.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.3 t -59.16 -22.17 60.53 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.285 -0.884 . . . . 0.0 111.549 170.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -58.67 -16.46 16.4 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 119.555 -1.966 . . . . 0.0 113.394 171.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -58.07 -34.57 70.27 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.31 0.959 . . . . 0.0 112.473 167.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -25.6 67.98 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.962 0.887 . . . . 0.0 112.303 -169.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.344 2.258 . . . . 0.0 113.616 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.738 0 C-N-CA 125.083 1.353 . . . . 0.0 112.731 -166.932 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.321 33.3 mm-40 . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 70.7 m 107.48 79.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 131.205 3.802 . . . . 0.0 114.017 167.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.7 -41.49 61.49 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 121.068 -1.02 . . . . 0.0 110.837 172.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.442 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 13.8 mtmt -63.19 -15.1 55.86 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.299 2.239 . . . . 0.0 115.809 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -123.85 7.72 8.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.456 1.502 . . . . 0.0 112.799 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 31.0 ttm -59.6 125.25 22.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.765 1.166 . . . . 0.0 109.353 174.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.56 153.76 33.03 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 -178.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.93 -32.49 73.79 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.427 -1.421 . . . . 0.0 112.8 -173.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -66.52 -30.88 71.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.968 0.804 . . . . 0.0 112.89 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -77.5 -38.69 48.51 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.794 1.238 . . . . 0.0 111.315 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.76 -51.27 70.46 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.486 0.714 . . . . 0.0 112.316 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.2 pt -68.27 -3.29 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.832 0.853 . . . . 0.0 112.861 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -105.72 -9.12 17.45 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 126.053 1.741 . . . . 0.0 114.112 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.57 158.13 36.76 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.828 1.195 . . . . 0.0 111.065 174.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -67.82 132.49 92.39 Favored Pre-proline 0 N--CA 1.485 1.283 0 O-C-N 121.04 -1.037 . . . . 0.0 112.128 -173.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -57.29 -16.91 24.15 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.829 3.019 . . . . 0.0 115.829 175.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -61.89 -64.11 1.04 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.0 1.72 . . . . 0.0 109.458 166.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.2 -4.18 56.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -177.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.8 mmt -52.42 -45.42 65.93 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.61 1.096 . . . . 0.0 111.704 168.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 83.3 m -60.88 -52.8 69.74 Favored Pre-proline 0 N--CA 1.48 1.05 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.877 -172.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -49.87 -49.46 15.96 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.232 3.288 . . . . 0.0 115.202 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.2 p -72.4 -36.41 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 119.485 1.039 . . . . 0.0 112.934 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.98 67.43 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.518 1.127 . . . . 0.0 111.35 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.523 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.6 t90 -84.21 -53.83 5.23 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 117.826 -1.083 . . . . 0.0 110.883 166.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.523 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.9 t90 -62.29 -33.03 73.87 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 116.495 -2.082 . . . . 0.0 113.159 -164.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -59.72 -42.57 93.38 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.225 1.01 . . . . 0.0 112.635 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.545 0.763 0 C-N-CA 126.525 1.93 . . . . 0.0 112.435 -172.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 . . . . . 0 N--CA 1.468 0.442 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -56.32 -30.18 62.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.385 0.674 . . . . 0.0 112.259 173.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.6 m -79.7 -39.4 31.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.222 1.009 . . . . 0.0 112.092 172.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -70.89 -36.67 72.85 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.512 -1.368 . . . . 0.0 113.545 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.97 -41.95 90.66 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.592 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -76.0 -35.47 2.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.094 1.863 . . . . 0.0 113.653 169.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -67.22 -28.05 67.74 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.189 -1.569 . . . . 0.0 114.166 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.1 m -71.2 -24.72 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.843 -0.536 . . . . 0.0 112.035 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 36.7 mt -74.22 -47.95 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.196 0.999 . . . . 0.0 109.965 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -54.65 -48.27 72.51 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.745 0.818 . . . . 0.0 112.029 172.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -68.0 -24.74 65.16 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.792 -1.193 . . . . 0.0 112.151 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -76.54 -47.67 21.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 118.422 -0.799 . . . . 0.0 112.626 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 120.826 1.648 . . . . 0.0 114.047 176.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -69.45 -30.37 68.27 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 167.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -133.7 64.79 69.11 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.975 1.31 . . . . 0.0 112.395 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -58.7 -16.73 32.16 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.101 2.534 . . . . 0.0 116.704 -170.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -83.24 -15.02 51.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.998 1.319 . . . . 0.0 113.347 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.04 162.36 28.11 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.891 1.277 . . . . 0.0 112.007 -172.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -76.98 157.09 31.45 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -73.0 -48.45 36.23 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 174.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.442 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 5.1 m-85 -77.86 -18.06 56.66 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 116.161 1.911 . . . . 0.0 116.161 -168.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.2 t -58.88 -24.2 61.93 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.383 -0.823 . . . . 0.0 111.686 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -61.51 -4.1 1.22 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 119.787 -1.82 . . . . 0.0 114.242 171.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -71.21 -31.92 68.17 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.705 1.139 . . . . 0.0 112.168 166.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -63.11 -34.13 76.95 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -168.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -70.13 -26.27 63.87 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.824 2.05 . . . . 0.0 114.766 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.635 0 C-N-CA 125.432 1.493 . . . . 0.0 113.204 -168.338 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t 80.26 117.5 0.06 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.601 2.761 . . . . 0.0 117.439 167.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.16 -25.41 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.314 -0.866 . . . . 0.0 113.17 175.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -59.82 -30.26 68.8 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.603 1.561 . . . . 0.0 113.097 177.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -107.6 4.62 26.12 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.062 1.745 . . . . 0.0 113.144 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.1 ttm -64.62 124.84 22.93 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.855 -1.153 . . . . 0.0 110.374 175.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.81 155.68 27.75 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.013 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -62.35 -34.38 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.57 -1.331 . . . . 0.0 112.898 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -60.47 -32.03 71.02 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 171.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -82.37 -37.63 25.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.265 1.426 . . . . 0.0 111.602 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.42 -48.39 81.84 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.641 0.777 . . . . 0.0 112.61 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -68.27 -3.66 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 124.18 0.992 . . . . 0.0 112.618 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -111.99 -4.8 14.41 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 125.627 1.571 . . . . 0.0 114.148 176.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.78 159.44 32.92 Favored 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.78 -1.2 . . . . 0.0 111.389 177.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -54.01 134.02 58.5 Favored Pre-proline 0 N--CA 1.484 1.227 0 C-N-CA 124.81 1.244 . . . . 0.0 113.8 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.48 -15.49 41.8 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.085 2.523 . . . . 0.0 116.223 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.2 mptt -71.08 -55.51 8.08 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 120.759 1.618 . . . . 0.0 109.331 170.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.44 -0.18 48.95 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -175.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.76 -40.42 95.08 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.256 23.2 m -66.94 -50.95 40.36 Favored Pre-proline 0 N--CA 1.481 1.093 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -175.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.1 -42.13 47.02 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.607 2.871 . . . . 0.0 115.538 169.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.2 p -73.64 -40.75 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.432 1.014 . . . . 0.0 113.241 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.75 66.65 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.754 0.822 . . . . 0.0 111.494 174.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.494 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 76.7 t90 -87.97 -50.48 6.39 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.05 -1.452 . . . . 0.0 112.104 168.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.42 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 2.0 t90 -67.62 -26.9 66.47 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 121.685 2.039 . . . . 0.0 112.12 -168.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.41 -43.01 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.663 0.785 . . . . 0.0 111.777 169.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 125.812 1.645 . . . . 0.0 111.766 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.221 -0.442 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.02 -21.52 66.54 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 120.969 -1.082 . . . . 0.0 112.207 177.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.4 m -81.48 -37.42 27.95 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.987 0.915 . . . . 0.0 111.438 169.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -83.74 -28.07 28.48 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.776 1.171 . . . . 0.0 113.864 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.27 -42.88 96.22 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 119.985 1.266 . . . . 0.0 112.152 176.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.53 -35.5 10.3 Favored 'Trans proline' 0 C--N 1.353 0.788 0 CA-C-N 122.145 1.802 . . . . 0.0 113.269 169.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -66.1 -36.33 82.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.109 -1.62 . . . . 0.0 113.671 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.12 -20.78 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.798 0.727 . . . . 0.0 112.573 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 39.3 mt -82.34 -50.67 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.062 0.945 . . . . 0.0 110.558 171.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.25 -38.71 77.43 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 123.853 0.861 . . . . 0.0 111.9 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -69.41 -29.09 66.75 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.954 0.502 . . . . 0.0 111.601 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.6 m -77.19 -46.27 23.88 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.922 174.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -29.47 68.41 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.974 1.716 . . . . 0.0 114.159 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -75.64 -29.08 59.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -134.66 74.63 64.67 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.971 1.309 . . . . 0.0 111.871 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -58.37 -12.44 13.56 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.442 3.428 . . . . 0.0 117.445 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -79.63 -23.95 42.25 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.884 1.273 . . . . 0.0 113.401 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt -64.85 154.66 36.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.37 1.068 . . . . 0.0 112.085 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -80.99 151.58 28.39 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.427 -0.796 . . . . 0.0 109.622 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.0 tp -66.33 -36.55 83.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.86 -1.15 . . . . 0.0 113.132 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.45 -20.94 30.93 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -64.27 -14.54 56.47 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.214 -0.929 . . . . 0.0 112.288 169.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -66.78 -3.52 6.95 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 119.156 -2.215 . . . . 0.0 113.906 169.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -32.77 56.18 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.71 1.204 . . . . 0.0 111.199 165.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -65.69 -29.93 70.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.69 1.596 . . . . 0.0 112.279 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -74.24 -29.61 61.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.579 1.552 . . . . 0.0 114.765 174.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 124.927 1.291 . . . . 0.0 113.767 -167.719 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 . . . . . 0 N--CA 1.443 -0.784 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 69.5 m -86.43 91.78 8.63 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.808 1.643 . . . . 0.0 113.378 -165.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.91 -35.67 64.39 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 120.385 -1.447 . . . . 0.0 110.789 170.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.464 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 18.2 mtmt -76.5 -4.33 42.09 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.303 2.241 . . . . 0.0 115.942 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -134.72 17.26 3.58 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.719 1.208 . . . . 0.0 112.207 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 58.6 ttm -59.63 134.44 57.02 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 121.292 -0.88 . . . . 0.0 108.711 170.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -72.02 166.94 21.2 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.468 1.128 . . . . 0.0 112.176 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.69 -31.27 68.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.212 170.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -65.45 -38.36 89.61 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.055 0.843 . . . . 0.0 112.397 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -68.76 -41.57 78.7 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 121.459 -0.776 . . . . 0.0 112.094 172.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -59.46 -47.71 84.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.616 0.644 . . . . 0.0 111.947 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -71.27 -13.26 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.676 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.46 -24.42 20.71 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.467 1.031 . . . . 0.0 113.547 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.03 155.47 36.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.38 1.072 . . . . 0.0 112.139 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . 0.48 HD22 ' HD2' ' B' ' 98' ' ' LYS . 36.7 t30 -75.16 139.4 72.45 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -65.58 -16.5 54.0 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 121.918 1.745 . . . . 0.0 116.238 -172.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . 0.48 ' HD2' HD22 ' B' ' 96' ' ' ASN . 6.2 mptt -60.08 -61.11 2.85 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.672 -1.268 . . . . 0.0 110.46 168.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.1 -8.99 57.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -177.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -57.31 -40.66 78.35 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.02 -1.05 . . . . 0.0 110.911 168.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.5 m -57.87 -57.77 23.3 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.39 1.076 . . . . 0.0 113.113 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.78 -40.54 79.73 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 124.12 3.213 . . . . 0.0 115.791 172.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -76.8 -36.56 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 CA-C-N 120.717 1.599 . . . . 0.0 113.355 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.02 -29.48 69.74 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.755 0.822 . . . . 0.0 111.03 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.518 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 67.5 t90 -80.06 -53.05 7.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 117.869 -1.062 . . . . 0.0 112.772 169.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.518 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.17 -30.05 70.44 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 117.909 -1.516 . . . . 0.0 111.305 -168.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -58.56 -34.5 71.12 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.705 0.802 . . . . 0.0 112.896 171.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mm? . . . . . 0 CA--C 1.548 0.873 0 C-N-CA 126.442 1.897 . . . . 0.0 114.468 178.615 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.2 mt -56.83 -31.53 64.83 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.812 0.845 . . . . 0.0 112.544 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 38.1 m -80.71 -35.98 32.82 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.928 0.891 . . . . 0.0 112.144 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -81.73 -30.01 32.66 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.93 -40.51 72.4 Favored Pre-proline 0 CA--C 1.555 1.148 0 CA-C-N 120.525 1.511 . . . . 0.0 113.723 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -74.05 -37.46 2.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 CA-C-N 122.067 1.774 . . . . 0.0 113.632 169.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -67.68 -30.27 69.75 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 120.372 -1.455 . . . . 0.0 114.181 -174.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -67.64 -24.22 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.584 . . . . 0.0 112.379 173.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 48.9 mt -72.87 -53.16 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.209 1.004 . . . . 0.0 109.734 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -55.26 -53.74 52.24 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.469 0.707 . . . . 0.0 110.967 176.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.81 -24.96 67.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.191 -0.943 . . . . 0.0 112.816 -177.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -78.82 -47.62 16.31 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.648 1.113 . . . . 0.0 112.314 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -25.28 67.94 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 120.93 1.695 . . . . 0.0 113.463 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -74.81 -26.85 60.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.455 1.502 . . . . 0.0 114.959 169.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -135.85 62.49 47.39 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.331 1.453 . . . . 0.0 110.871 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.47 -16.0 39.42 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.577 2.851 . . . . 0.0 114.773 -171.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -78.39 -23.88 46.58 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.973 1.709 . . . . 0.0 114.283 -177.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -67.1 164.42 18.0 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.27 1.428 . . . . 0.0 112.901 -173.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.37 131.04 37.12 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 168.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.6 tp -46.03 -37.99 7.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.739 1.616 . . . . 0.0 113.728 179.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.464 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 7.2 m-85 -78.31 -8.64 58.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.0 p -65.44 -24.3 67.15 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 120.786 -1.197 . . . . 0.0 111.636 168.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -72.97 -2.48 21.18 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -80.04 -32.11 39.51 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.663 1.12 . . . . 0.0 111.632 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -68.33 -30.85 69.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.744 0.818 . . . . 0.0 112.078 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -73.34 -28.56 62.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.258 1.823 . . . . 0.0 115.253 169.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 125.189 1.395 . . . . 0.0 114.021 -165.773 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.406 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 19.8 mm-40 . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.201 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 t 100.24 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.261 3.024 . . . . 0.0 115.138 169.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.79 -26.28 68.56 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.073 -1.642 . . . . 0.0 111.01 169.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HD3' ' CE1' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -67.15 -20.26 65.72 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.961 2.104 . . . . 0.0 113.782 175.452 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -115.58 5.2 14.31 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.937 1.295 . . . . 0.0 113.29 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.1 ttm -62.62 123.24 17.84 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.017 -1.052 . . . . 0.0 109.977 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -79.17 155.4 28.67 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.227 -0.921 . . . . 0.0 110.695 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.11 -34.97 75.8 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.604 -1.31 . . . . 0.0 112.831 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -61.62 -33.38 73.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.95 0.796 . . . . 0.0 112.95 172.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -78.63 -37.36 42.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.994 1.318 . . . . 0.0 111.607 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.81 -49.64 76.91 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.613 0.765 . . . . 0.0 112.409 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.6 pt -68.38 -5.87 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.324 1.05 . . . . 0.0 112.896 177.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -105.16 -8.84 18.13 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.412 1.485 . . . . 0.0 113.494 174.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.36 159.87 31.8 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 120.957 -1.089 . . . . 0.0 111.203 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -67.64 130.08 93.23 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.039 -1.038 . . . . 0.0 112.187 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.79 -16.99 12.48 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.809 3.673 . . . . 0.0 116.396 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -64.4 -67.62 0.42 Allowed 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.813 2.045 . . . . 0.0 108.649 166.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.84 -10.45 59.51 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.38 -34.91 73.0 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.272 19.1 m -66.3 -52.65 36.24 Favored Pre-proline 0 N--CA 1.481 1.081 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -50.98 -43.95 44.81 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.368 2.712 . . . . 0.0 115.469 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.3 p -73.04 -38.45 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-N 119.218 0.917 . . . . 0.0 113.095 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.21 -20.51 66.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.254 1.022 . . . . 0.0 111.783 174.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.474 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 58.4 t90 -88.65 -51.2 5.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.81 168.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.426 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 1.9 t90 -69.2 -31.08 69.44 Favored 'General case' 0 C--N 1.351 0.63 0 CA-C-N 120.025 1.284 . . . . 0.0 112.252 -168.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -63.92 -43.84 94.7 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.625 0.77 . . . . 0.0 110.995 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 CA--C 1.542 0.652 0 C-N-CA 124.592 1.157 . . . . 0.0 112.802 -173.208 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.465 0.324 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.07 -22.3 66.94 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.129 -0.982 . . . . 0.0 111.812 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.9 m -79.17 -36.87 39.66 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.172 0.989 . . . . 0.0 111.67 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -82.65 -33.59 27.74 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.551 -1.343 . . . . 0.0 113.876 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.43 -42.38 87.28 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.696 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.41 -37.93 7.0 Favored 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 122.119 1.793 . . . . 0.0 113.385 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -67.02 -34.45 77.75 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.149 -1.594 . . . . 0.0 113.68 -176.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.6 m -67.52 -16.2 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 173.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.7 mt -90.58 -50.73 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.221 1.408 . . . . 0.0 110.687 172.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.28 -39.14 78.46 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.309 1.043 . . . . 0.0 111.482 177.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -70.14 -24.29 63.15 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.14 -0.975 . . . . 0.0 111.52 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.82 -44.8 17.91 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.999 0.92 . . . . 0.0 112.031 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -27.69 69.37 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 120.666 1.575 . . . . 0.0 113.526 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -69.56 -35.12 75.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 168.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -130.04 65.78 76.21 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.682 1.193 . . . . 0.0 112.263 -178.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -55.71 -14.43 10.43 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.53 2.82 . . . . 0.0 117.033 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -84.85 -21.41 29.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.375 1.47 . . . . 0.0 113.65 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -70.07 158.32 35.92 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.327 1.051 . . . . 0.0 111.981 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -94.91 133.37 38.72 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.4 tp -49.64 -42.81 46.07 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -168.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.438 ' CE1' ' HD3' ' A' ' 6' ' ' LYS . 7.5 m-85 -75.0 -8.56 56.86 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -178.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 69.0 p -60.41 -27.37 67.4 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.349 -1.47 . . . . 0.0 111.517 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -72.87 -3.85 28.22 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.76 1.224 . . . . 0.0 113.7 177.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -79.73 -30.95 41.05 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.338 0.972 . . . . 0.0 111.747 168.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -69.71 -26.03 64.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.72 1.208 . . . . 0.0 112.243 -170.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -76.88 -31.82 57.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.843 1.657 . . . . 0.0 114.872 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.503 0 C-N-CA 124.304 1.042 . . . . 0.0 113.658 -167.705 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.1 t 101.62 95.09 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.68 3.192 . . . . 0.0 116.305 168.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.22 -37.39 77.38 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.339 -1.476 . . . . 0.0 112.202 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.3 ptpt -76.01 -13.22 60.23 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -107.92 7.26 27.91 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.656 1.183 . . . . 0.0 113.051 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 40.5 ttm -62.55 128.66 37.02 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.795 -1.19 . . . . 0.0 109.829 173.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -77.17 154.55 33.04 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 120.929 -1.107 . . . . 0.0 110.744 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.16 -33.67 74.95 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.225 -1.547 . . . . 0.0 113.277 -174.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -30.79 71.15 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 119.171 0.896 . . . . 0.0 112.22 173.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -76.54 -37.23 56.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.677 1.191 . . . . 0.0 111.504 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.25 -49.63 76.33 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.418 -0.801 . . . . 0.0 113.022 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 9.0 pt -66.61 -8.86 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -102.08 -12.14 18.33 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.114 1.766 . . . . 0.0 114.015 173.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.51 157.73 37.35 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.616 1.098 . . . . 0.0 111.45 176.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -57.51 134.66 82.06 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.421 1.088 . . . . 0.0 113.458 178.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -75.92 -6.32 17.3 Favored 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 121.483 1.456 . . . . 0.0 115.176 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . 0.406 ' HG3' ' C ' ' A' ' 3' ' ' GLU . 6.3 mptt -70.04 -55.28 9.94 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.454 1.479 . . . . 0.0 109.207 168.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.72 -9.61 55.53 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -178.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.2 ttm -56.06 -30.91 62.64 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 120.243 -1.536 . . . . 0.0 112.731 169.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.7 m -66.05 -57.2 13.96 Favored Pre-proline 0 N--CA 1.482 1.153 0 CA-C-O 117.813 -1.089 . . . . 0.0 112.603 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.43 -36.43 79.41 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.916 3.077 . . . . 0.0 114.113 169.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.06 -53.29 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 119.275 0.943 . . . . 0.0 111.196 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.16 75.22 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.235 1.014 . . . . 0.0 111.257 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.491 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.9 t90 -69.37 -53.68 18.29 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 117.649 -1.167 . . . . 0.0 112.22 169.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.491 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.6 t90 -65.09 -32.35 74.02 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.03 -1.468 . . . . 0.0 111.998 -167.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 62.8 ttp -53.63 -46.03 70.36 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.544 1.137 . . . . 0.0 111.893 169.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 CA--C 1.546 0.793 0 C-N-CA 125.015 1.326 . . . . 0.0 113.841 -178.08 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.4 mt -57.07 -26.29 60.15 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.3 m -83.54 -32.41 25.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.918 1.287 . . . . 0.0 112.597 173.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -78.71 -34.51 45.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.775 -1.203 . . . . 0.0 113.447 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.49 -38.26 60.04 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 117.379 -1.296 . . . . 0.0 113.474 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -75.6 -37.55 1.7 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 CA-C-N 122.246 1.838 . . . . 0.0 113.18 168.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -64.02 -33.52 75.93 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.593 -1.317 . . . . 0.0 113.766 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.53 -26.4 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.575 0.75 . . . . 0.0 112.789 178.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 52.3 mt -69.42 -50.1 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.632 0.773 . . . . 0.0 109.323 171.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.4 -42.49 91.9 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.055 0.942 . . . . 0.0 111.878 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.57 -25.7 65.03 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.735 -1.228 . . . . 0.0 112.117 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.54 -45.38 25.58 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.288 -0.883 . . . . 0.0 111.829 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -27.29 68.77 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.459 1.481 . . . . 0.0 113.652 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -71.11 -36.04 72.0 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 168.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -127.51 62.62 55.61 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.234 1.414 . . . . 0.0 110.727 -176.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.83 -13.63 27.8 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.521 2.814 . . . . 0.0 114.786 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -81.69 -23.66 36.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.132 1.773 . . . . 0.0 114.304 -178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -66.26 156.93 32.86 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.84 1.256 . . . . 0.0 112.072 -175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -89.57 131.78 35.41 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.1 tp -48.17 -52.35 21.11 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -168.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.88 -8.03 40.2 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -174.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 72.6 p -57.59 -27.29 62.59 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 120.539 -1.351 . . . . 0.0 111.118 168.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -71.22 -3.86 22.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.469 1.508 . . . . 0.0 114.48 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -34.55 40.6 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.772 1.169 . . . . 0.0 111.655 167.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.75 -31.41 66.63 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.018 1.327 . . . . 0.0 112.392 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -66.06 -30.31 70.81 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.306 1.442 . . . . 0.0 114.456 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -167.803 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 . . . . . 0 N--CA 1.444 -0.735 0 N-CA-C 105.12 -2.178 . . . . 0.0 105.12 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 t -104.73 116.1 31.45 Favored 'General case' 0 CA--C 1.505 -0.756 0 O-C-N 120.585 -1.322 . . . . 0.0 112.313 -166.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.14 -32.82 73.36 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.091 167.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.43 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.4 mtmt -63.24 -28.96 70.39 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.504 1.922 . . . . 0.0 114.209 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -113.59 10.44 18.07 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.236 1.414 . . . . 0.0 112.647 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 12.7 ttm -64.29 123.43 19.12 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.726 -1.234 . . . . 0.0 108.616 170.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.8 t -79.36 157.85 27.55 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.117 -0.989 . . . . 0.0 110.695 -174.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.53 -35.6 78.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.587 -1.32 . . . . 0.0 112.84 -174.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -61.24 -33.44 73.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -79.9 -38.48 32.47 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.12 1.368 . . . . 0.0 111.67 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -59.19 -49.65 77.04 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.991 0.917 . . . . 0.0 112.705 176.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -67.71 -5.15 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 C-N-CA 124.362 1.065 . . . . 0.0 112.641 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -107.26 -6.83 17.01 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.325 1.45 . . . . 0.0 113.707 173.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.02 160.82 29.44 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.915 -1.115 . . . . 0.0 110.94 175.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -64.78 131.08 95.05 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 121.157 -0.964 . . . . 0.0 111.999 -176.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -60.61 -16.53 43.54 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.437 2.758 . . . . 0.0 114.969 -178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -60.27 -67.39 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.717 1.607 . . . . 0.0 110.161 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.12 -3.74 53.02 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 ttt -57.71 -40.46 79.57 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 169.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -64.83 -54.18 37.35 Favored Pre-proline 0 N--CA 1.481 1.125 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -48.97 -44.41 32.52 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.732 2.955 . . . . 0.0 115.886 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.1 p -72.5 -42.25 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.28 -35.69 70.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.877 0.471 . . . . 0.0 110.229 171.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 75.1 t90 -76.3 -49.84 15.9 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.587 177.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.422 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 1.4 t90 -64.75 -25.33 67.88 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 120.383 1.447 . . . . 0.0 111.264 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -66.92 -50.71 61.52 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.422 1.489 . . . . 0.0 111.693 168.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.856 0 C-N-CA 124.543 1.137 . . . . 0.0 113.765 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.2 t70 . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.0 mt -61.22 -33.61 73.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.892 0.877 . . . . 0.0 112.412 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.2 m -72.9 -35.91 67.19 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.424 1.09 . . . . 0.0 111.404 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm100 -78.52 -24.06 45.94 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.759 -1.115 . . . . 0.0 113.134 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.95 -47.93 95.45 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 120.352 1.433 . . . . 0.0 112.399 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.48 -34.1 21.09 Favored 'Trans proline' 0 C--N 1.354 0.864 0 CA-C-N 121.865 1.702 . . . . 0.0 113.342 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -67.58 -34.33 76.82 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.502 1.501 . . . . 0.0 114.057 -177.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.13 -20.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.77 0.714 . . . . 0.0 112.79 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.83 -50.37 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.501 1.121 . . . . 0.0 110.781 171.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.56 -39.07 79.25 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.9 0.88 . . . . 0.0 111.783 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -69.23 -28.81 66.68 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.434 0.561 . . . . 0.0 111.627 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.7 m -77.68 -46.72 21.1 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.293 -0.88 . . . . 0.0 112.921 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -28.96 67.55 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.85 1.659 . . . . 0.0 114.334 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -75.0 -30.23 61.08 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 173.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -134.13 75.4 65.88 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.098 1.359 . . . . 0.0 112.137 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -59.27 -9.59 8.79 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.405 3.403 . . . . 0.0 117.297 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -81.9 -21.68 37.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.351 1.46 . . . . 0.0 113.129 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -68.76 160.35 30.58 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.809 1.244 . . . . 0.0 111.387 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -83.7 152.04 24.94 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.619 -0.676 . . . . 0.0 110.759 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.9 tp -67.5 -35.4 79.06 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.08 -1.012 . . . . 0.0 113.357 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.43 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -90.91 -23.85 20.37 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -58.83 -23.6 60.8 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.366 -0.834 . . . . 0.0 111.675 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -61.46 -4.77 1.41 Allowed 'General case' 0 CA--C 1.539 0.548 0 O-C-N 119.692 -1.88 . . . . 0.0 113.696 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -35.17 67.05 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 120.957 -1.089 . . . . 0.0 111.945 167.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.77 -30.51 71.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.916 0.886 . . . . 0.0 113.249 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -73.56 -23.14 59.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.729 1.612 . . . . 0.0 114.395 173.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.844 0 C-N-CA 127.0 2.12 . . . . 0.0 116.015 -166.561 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 . . . . . 0 N--CA 1.444 -0.763 0 N-CA-C 103.795 -2.668 . . . . 0.0 103.795 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.2 m -86.44 86.52 7.34 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 125.019 1.328 . . . . 0.0 113.416 -164.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.31 53.53 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.084 1.311 . . . . 0.0 111.033 171.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.408 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 9.4 ptpt -77.67 -0.51 26.96 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.958 2.103 . . . . 0.0 116.411 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -136.45 19.07 3.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.979 1.312 . . . . 0.0 112.233 170.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.4 ttm -60.75 123.22 16.86 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.899 -1.126 . . . . 0.0 108.192 169.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.76 153.87 32.49 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.577 -0.702 . . . . 0.0 109.963 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -61.51 -33.48 73.88 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.805 -1.185 . . . . 0.0 112.991 -173.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -65.94 -30.99 71.66 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.024 0.829 . . . . 0.0 112.975 173.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -77.33 -37.89 51.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.976 1.311 . . . . 0.0 111.101 173.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -62.78 -48.98 76.78 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.446 -0.784 . . . . 0.0 112.702 177.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.6 pt -69.21 -4.11 3.44 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 123.597 0.759 . . . . 0.0 112.977 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.8 -12.62 16.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.145 1.778 . . . . 0.0 114.124 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 159.78 32.87 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 119.763 1.165 . . . . 0.0 110.849 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -66.66 129.09 94.11 Favored Pre-proline 0 N--CA 1.483 1.206 0 O-C-N 121.384 -0.822 . . . . 0.0 111.165 -177.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.77 -18.17 47.19 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.927 2.418 . . . . 0.0 114.786 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -56.14 -66.76 0.38 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.184 1.793 . . . . 0.0 109.495 168.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.5 -7.22 59.55 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 17.3 ttm -56.82 -43.27 80.86 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.958 -1.089 . . . . 0.0 111.544 169.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 60.3 m -55.61 -57.48 20.88 Favored Pre-proline 0 N--CA 1.484 1.228 0 CA-C-O 118.036 -0.983 . . . . 0.0 113.551 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -52.93 -43.39 57.06 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.21 3.273 . . . . 0.0 115.621 172.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.2 p -73.92 -39.24 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 120.235 1.38 . . . . 0.0 113.263 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.29 -29.89 69.12 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.086 0.954 . . . . 0.0 111.061 172.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.51 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 61.1 t90 -79.37 -53.49 6.87 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.353 169.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.51 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.5 t90 -64.55 -29.9 70.93 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 120.903 1.683 . . . . 0.0 112.65 -167.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -61.36 -51.28 69.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.355 1.062 . . . . 0.0 111.415 171.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.685 0 C-N-CA 125.671 1.588 . . . . 0.0 111.666 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.7 mt -54.27 -36.75 63.96 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 33.9 m -77.38 -35.03 54.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.166 0.586 . . . . 0.0 111.852 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -79.44 -23.61 43.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 117.57 -1.205 . . . . 0.0 114.071 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mm -53.09 -47.21 96.61 Favored Pre-proline 0 N--CA 1.483 1.182 0 CA-C-N 120.757 1.617 . . . . 0.0 112.406 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.53 -32.0 12.8 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.663 1.575 . . . . 0.0 113.759 172.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.47 -35.68 80.87 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.877 -1.139 . . . . 0.0 113.171 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.8 m -69.33 -26.39 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.476 0.58 . . . . 0.0 112.341 174.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.08 -51.1 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.334 0.654 . . . . 0.0 110.334 172.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -52.49 -47.86 66.29 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.841 0.856 . . . . 0.0 112.075 173.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -69.5 -23.37 63.61 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.175 -0.953 . . . . 0.0 112.311 -175.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -78.43 -48.23 15.87 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.277 -0.89 . . . . 0.0 112.049 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -27.25 69.04 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.929 1.241 . . . . 0.0 113.646 174.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -70.94 -33.54 70.6 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -128.22 63.19 62.0 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.171 1.388 . . . . 0.0 111.029 -176.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.2 -14.77 20.78 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.142 3.228 . . . . 0.0 116.608 -169.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -89.41 -18.23 27.22 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 -178.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -66.45 158.96 28.16 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.573 1.149 . . . . 0.0 112.033 -176.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.02 130.75 34.88 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 62.2 tp -46.14 -37.03 6.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 114.027 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.408 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.5 m-85 -78.76 -9.78 59.55 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.7 p -64.77 -24.28 67.51 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 120.603 -1.311 . . . . 0.0 111.671 168.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -73.41 -3.72 29.13 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -78.89 -35.03 44.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.922 1.289 . . . . 0.0 111.558 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -68.34 -32.17 72.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.6 1.16 . . . . 0.0 112.39 -169.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -70.12 -29.24 66.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 115.007 173.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.866 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 . . . . . 0 N--CA 1.471 0.589 0 CA-C-O 117.855 -1.069 . . . . 0.0 112.654 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.5 m 99.24 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 129.645 3.178 . . . . 0.0 115.768 167.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.15 -35.92 72.23 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.997 -1.689 . . . . 0.0 112.339 175.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.491 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -73.13 1.59 8.86 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 173.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -126.22 6.6 7.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.118 1.367 . . . . 0.0 112.126 168.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.2 ttm -61.61 126.92 29.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.752 -1.217 . . . . 0.0 109.725 172.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.4 t -78.53 154.14 30.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.0 -33.08 74.65 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.8 -1.188 . . . . 0.0 113.132 -174.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -61.88 -32.15 72.49 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -78.62 -38.26 40.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.635 1.174 . . . . 0.0 111.605 175.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -58.13 -50.32 73.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.1 pt -67.5 -7.96 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.48 1.112 . . . . 0.0 113.178 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -105.0 -8.58 18.45 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 125.812 1.645 . . . . 0.0 113.615 175.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.34 159.4 33.4 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 121.065 -1.022 . . . . 0.0 110.738 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -75.93 137.29 69.52 Favored Pre-proline 0 N--CA 1.483 1.199 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -168.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.56 -14.27 41.55 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.159 2.573 . . . . 0.0 116.486 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -63.31 -61.3 2.44 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 125.449 1.5 . . . . 0.0 108.589 166.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.93 -10.19 59.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -176.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.8 ttt -58.63 -35.08 71.92 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.4 m -64.73 -54.56 35.03 Favored Pre-proline 0 N--CA 1.483 1.182 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -176.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -54.71 -36.85 91.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.902 2.401 . . . . 0.0 115.739 173.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -38.45 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 119.492 1.042 . . . . 0.0 113.549 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -26.41 67.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.876 0.87 . . . . 0.0 111.151 173.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.517 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 70.7 t90 -87.28 -52.4 5.42 Favored 'General case' 0 C--N 1.343 0.304 0 CA-C-O 117.443 -1.265 . . . . 0.0 112.887 169.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.517 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.5 t90 -67.64 -24.72 65.48 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 121.297 1.862 . . . . 0.0 112.25 -167.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -63.85 -50.16 69.97 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.215 1.006 . . . . 0.0 111.349 169.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.786 0 C-N-CA 125.216 1.406 . . . . 0.0 111.852 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 54.7 mt -66.04 -28.99 69.27 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.551 -0.718 . . . . 0.0 112.025 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.1 m -74.73 -38.53 62.25 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.795 0.838 . . . . 0.0 111.373 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -79.39 -31.16 42.73 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 117.53 -1.224 . . . . 0.0 113.555 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.5 mp -51.23 -42.16 79.47 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 120.79 1.632 . . . . 0.0 113.305 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -71.76 -38.37 4.3 Favored 'Trans proline' 0 C--N 1.352 0.763 0 CA-C-N 122.138 1.799 . . . . 0.0 113.574 169.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mmtt -67.19 -33.41 75.33 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.084 -1.635 . . . . 0.0 113.801 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.3 m -68.2 -18.5 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.1 mt -87.68 -50.44 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.632 1.173 . . . . 0.0 110.268 172.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -58.56 -36.83 74.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.091 0.957 . . . . 0.0 111.934 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -70.85 -28.72 64.8 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.604 0.638 . . . . 0.0 111.882 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -77.11 -41.52 41.73 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.982 -1.073 . . . . 0.0 112.658 176.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -29.2 67.5 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 120.71 1.595 . . . . 0.0 113.973 177.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.417 ' HG3' HD21 ' A' ' 61' ' ' ASN . 14.0 ptpt -81.48 -27.5 34.54 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.417 HD21 ' HG3' ' A' ' 60' ' ' LYS . 17.8 m-80 -130.8 70.84 82.58 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.625 1.57 . . . . 0.0 110.754 173.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.92 -11.99 13.85 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 124.858 3.705 . . . . 0.0 116.368 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -84.63 -21.45 30.28 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.359 1.464 . . . . 0.0 113.292 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -67.9 156.34 37.41 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.669 0.787 . . . . 0.0 111.996 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -89.06 131.72 35.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.4 -38.42 28.85 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -169.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.491 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.26 5.4 m-85 -78.46 -8.3 58.37 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.369 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.7 p -61.01 -23.54 65.48 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.416 -1.427 . . . . 0.0 111.633 167.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.82 -10.72 59.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.699 -1.25 . . . . 0.0 112.568 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -31.78 71.44 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.725 1.148 . . . . 0.0 111.185 168.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.42 -13.44 62.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.642 1.177 . . . . 0.0 112.312 -173.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -82.87 -29.85 29.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.398 2.279 . . . . 0.0 114.689 173.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -164.029 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 . . . . . 0 N--CA 1.473 0.701 0 CA-C-O 118.873 -0.584 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.2 t 94.44 104.52 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.407 3.083 . . . . 0.0 116.231 168.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.64 74.89 Favored 'General case' 0 CA--C 1.551 0.996 0 O-C-N 120.711 -1.243 . . . . 0.0 111.191 169.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.454 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 23.4 mtmt -62.61 -28.03 69.61 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.416 1.486 . . . . 0.0 114.178 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -105.91 8.23 32.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.634 1.173 . . . . 0.0 113.478 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 49.2 ttm -63.91 130.34 43.69 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.644 -1.285 . . . . 0.0 110.392 173.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.2 t -79.32 156.28 28.1 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.01 -1.056 . . . . 0.0 110.814 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.25 -32.67 71.37 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.079 -1.638 . . . . 0.0 112.884 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -63.3 -32.13 73.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -74.96 -40.4 60.78 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.646 0.779 . . . . 0.0 111.938 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -60.34 -46.02 91.41 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.221 0.464 . . . . 0.0 111.892 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -72.21 -10.44 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.614 175.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.45 -20.25 20.48 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 170.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 156.0 37.15 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.029 0.932 . . . . 0.0 112.285 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -56.11 135.45 74.44 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.631 1.172 . . . . 0.0 113.203 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -75.39 -5.87 17.12 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.419 1.413 . . . . 0.0 115.474 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -70.68 -59.74 2.65 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.48 1.491 . . . . 0.0 109.509 167.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.55 -11.38 59.18 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -177.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 23.8 ttm -53.98 -31.09 49.66 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.611 -1.306 . . . . 0.0 112.92 171.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 36.3 m -68.44 -57.36 8.73 Favored Pre-proline 0 N--CA 1.484 1.254 0 CA-C-O 117.998 -1.001 . . . . 0.0 112.751 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.03 -36.27 75.43 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.83 3.02 . . . . 0.0 114.096 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 60.7 t -64.12 -52.17 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 121.469 -0.769 . . . . 0.0 111.395 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.42 -36.36 80.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.636 1.175 . . . . 0.0 111.372 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.513 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.7 t90 -71.31 -51.12 26.12 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 117.054 -1.45 . . . . 0.0 113.088 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.447 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.91 -27.68 67.69 Favored 'General case' 0 C--N 1.349 0.582 0 C-N-CA 116.911 -1.916 . . . . 0.0 111.139 -169.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.6 tmm? -60.59 -42.1 96.05 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.082 0.953 . . . . 0.0 112.217 169.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.046 1.338 . . . . 0.0 114.395 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.47 -29.96 62.35 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 42.5 m -81.07 -36.39 30.53 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.092 0.957 . . . . 0.0 112.187 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -80.24 -30.06 38.48 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.055 -1.028 . . . . 0.0 113.723 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.84 -41.4 84.53 Favored Pre-proline 0 CA--C 1.552 1.052 0 CA-C-N 120.351 1.432 . . . . 0.0 113.629 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -73.29 -37.32 3.39 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 CA-C-N 122.477 1.92 . . . . 0.0 113.468 169.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -67.65 -28.84 68.05 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 120.338 -1.477 . . . . 0.0 114.232 -175.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.25 -26.72 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 118.59 0.632 . . . . 0.0 112.076 173.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 43.6 mt -70.24 -51.27 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 123.927 0.891 . . . . 0.0 109.438 171.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -53.21 -48.85 67.8 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.79 0.836 . . . . 0.0 112.033 173.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -70.09 -25.1 63.36 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.124 -0.985 . . . . 0.0 112.075 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.34 -46.2 28.65 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.635 0.774 . . . . 0.0 112.177 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -26.69 67.36 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 120.389 1.45 . . . . 0.0 113.622 173.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttm -70.28 -31.58 69.0 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 168.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -133.18 65.25 72.77 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 125.046 1.338 . . . . 0.0 112.381 -179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -58.82 -15.29 25.93 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.094 2.529 . . . . 0.0 116.732 -171.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -83.7 -16.42 45.0 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.922 1.289 . . . . 0.0 113.603 -177.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -72.87 153.8 40.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.953 0.901 . . . . 0.0 111.375 -172.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -85.62 132.82 34.1 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.5 tp -51.52 -36.16 43.68 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.454 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 6.1 m-85 -81.76 -6.47 59.08 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.3 p -61.19 -27.55 68.5 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 120.524 -1.36 . . . . 0.0 111.317 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.37 -4.02 23.95 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.472 1.509 . . . . 0.0 114.317 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -29.46 37.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.97 1.308 . . . . 0.0 112.021 167.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.26 -32.31 64.62 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.646 1.178 . . . . 0.0 112.2 -171.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.36 -28.6 67.26 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.697 1.599 . . . . 0.0 114.864 173.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -166.965 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 . . . . . 0 N--CA 1.443 -0.789 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.8 t -102.57 103.44 13.77 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.367 1.467 . . . . 0.0 113.091 -164.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.99 70.52 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.434 -1.416 . . . . 0.0 110.748 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.482 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.0 ptpt -74.1 -4.69 37.14 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -125.83 12.29 7.87 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.151 1.381 . . . . 0.0 112.139 168.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.0 ttm -60.6 122.44 14.72 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.623 -1.298 . . . . 0.0 108.544 170.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.9 t -75.96 154.64 35.72 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.867 -1.146 . . . . 0.0 110.421 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.66 -30.94 71.97 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.267 -1.521 . . . . 0.0 113.342 -172.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -40.72 97.52 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.017 0.826 . . . . 0.0 111.928 170.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.69 -37.36 82.2 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.199 1.0 . . . . 0.0 111.568 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.65 -51.86 67.62 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.563 0.745 . . . . 0.0 112.353 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -69.43 -1.77 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 124.554 1.142 . . . . 0.0 112.737 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -106.59 -7.58 17.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.483 1.513 . . . . 0.0 113.587 171.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.14 160.71 29.48 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.021 -1.049 . . . . 0.0 111.135 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.2 t-20 -66.0 128.76 94.04 Favored Pre-proline 0 N--CA 1.484 1.273 0 O-C-N 121.024 -1.047 . . . . 0.0 111.528 -175.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.6 -21.02 23.11 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 124.094 3.196 . . . . 0.0 115.607 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mptt -57.89 -68.07 0.28 Allowed 'General case' 0 C--N 1.351 0.639 0 C-N-CA 126.117 1.767 . . . . 0.0 109.539 168.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.17 -7.9 57.64 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 10.9 ttt -62.84 -35.86 81.33 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.291 -1.505 . . . . 0.0 113.206 170.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.4 m -60.43 -53.66 62.53 Favored Pre-proline 0 N--CA 1.485 1.311 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.419 ' HA ' ' CE2' ' B' ' 106' ' ' TRP . 2.7 Cg_endo -49.31 -47.12 23.38 Favored 'Trans proline' 0 CA--C 1.51 -0.694 0 C-N-CA 123.389 2.726 . . . . 0.0 114.133 167.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.2 t -57.88 -32.94 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.807 0.443 . . . . 0.0 111.793 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.96 -27.42 65.71 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.385 1.074 . . . . 0.0 113.579 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.415 ' CB ' ' CH2' ' B' ' 106' ' ' TRP . 52.4 t90 -88.14 -39.38 14.58 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.81 1.186 . . . . 0.0 109.993 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.537 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 3.6 m95 -62.76 -35.08 78.67 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -167.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -72.85 -47.61 44.65 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.257 1.423 . . . . 0.0 112.787 168.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 124.829 1.251 . . . . 0.0 114.12 -168.81 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 . . . . . 0 N--CA 1.466 0.352 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.49 -25.15 68.13 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.141 -0.975 . . . . 0.0 112.439 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.0 m -78.54 -37.98 41.56 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.592 0.757 . . . . 0.0 111.467 171.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -81.7 -30.85 32.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.974 -1.012 . . . . 0.0 113.148 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.04 -41.68 75.56 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-O 117.232 -1.366 . . . . 0.0 113.008 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.95 -37.85 2.59 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 122.336 1.87 . . . . 0.0 113.807 168.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -67.82 -33.41 74.74 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.032 -1.667 . . . . 0.0 113.633 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 19.1 m -68.32 -13.95 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.4 mt -92.09 -51.09 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.635 1.174 . . . . 0.0 110.578 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.89 -35.52 73.15 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.974 0.909 . . . . 0.0 111.771 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -68.53 -29.62 68.24 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 122.078 -0.389 . . . . 0.0 111.915 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.27 -45.7 31.44 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.838 -1.164 . . . . 0.0 112.745 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.54 68.79 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.644 1.566 . . . . 0.0 113.977 177.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -77.06 -32.82 57.14 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -133.2 77.22 67.4 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 124.639 1.176 . . . . 0.0 112.094 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.55 -9.96 3.13 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 124.772 3.648 . . . . 0.0 117.024 175.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.39 -25.57 51.0 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.045 1.338 . . . . 0.0 112.511 -177.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -67.13 153.59 43.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.926 1.291 . . . . 0.0 111.448 -172.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -87.38 131.61 34.23 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 169.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -51.72 -36.72 47.99 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -169.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.482 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.0 m-85 -79.57 -6.85 57.9 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 58.8 p -59.79 -26.7 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.458 -1.401 . . . . 0.0 111.053 167.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -71.84 -3.1 20.35 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.754 1.622 . . . . 0.0 114.143 177.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -31.65 25.5 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.976 1.31 . . . . 0.0 111.693 169.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.3 -26.19 64.61 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.27 1.028 . . . . 0.0 112.151 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -74.85 -29.51 61.07 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.563 1.545 . . . . 0.0 114.929 171.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 125.04 1.336 . . . . 0.0 114.604 -166.61 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 15.6 t -93.94 97.56 10.44 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -166.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.74 -33.25 64.11 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 120.944 -1.098 . . . . 0.0 111.091 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -64.41 -31.33 72.49 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.537 1.935 . . . . 0.0 114.608 177.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -114.26 13.9 17.98 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.925 1.29 . . . . 0.0 113.132 -177.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.0 ttm -58.77 122.31 13.25 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.919 -1.113 . . . . 0.0 108.888 169.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.6 t -77.46 156.84 30.81 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.876 -1.14 . . . . 0.0 110.682 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.04 -34.06 76.76 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.142 -1.598 . . . . 0.0 112.909 -173.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -65.1 -31.45 72.66 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.192 0.906 . . . . 0.0 112.595 173.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -77.63 -37.08 50.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.784 1.234 . . . . 0.0 111.35 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -62.51 -49.42 75.44 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.331 -0.856 . . . . 0.0 112.28 176.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.05 -7.61 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.683 0.793 . . . . 0.0 112.971 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -100.88 -13.91 18.16 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.936 1.694 . . . . 0.0 113.877 171.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.34 158.42 35.11 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.454 1.025 . . . . 0.0 111.114 173.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -62.33 133.91 94.62 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.894 0.878 . . . . 0.0 112.815 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.43 -13.88 33.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.789 2.326 . . . . 0.0 116.042 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -66.38 -50.41 63.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 121.151 1.796 . . . . 0.0 107.929 168.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -87.98 -5.18 58.66 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 25.0 mtt -55.46 -44.48 76.44 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.652 -1.28 . . . . 0.0 111.98 169.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 89.4 m -61.17 -52.62 70.16 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 124.666 1.186 . . . . 0.0 113.088 -175.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . 0.462 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 11.6 Cg_endo -52.97 -49.75 16.48 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 124.047 3.165 . . . . 0.0 114.983 171.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.06 -37.05 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.672 -1.268 . . . . 0.0 112.867 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.38 -29.8 70.74 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.593 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.537 ' CD2' ' CZ2' ' A' ' 27' ' ' TRP . 73.2 t90 -81.81 -46.42 14.2 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.191 1.359 . . . . 0.0 112.452 173.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.419 ' CE2' ' HA ' ' A' ' 23' ' ' PRO . 0.0 OUTLIER -41.02 -38.55 1.01 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.703 0.801 . . . . 0.0 111.962 169.485 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 57.5 ttp -75.08 -64.58 1.02 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.409 1.484 . . . . 0.0 113.849 169.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 . . . . . 0 N--CA 1.466 0.36 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.2 mt -54.57 -33.67 60.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.145 0.978 . . . . 0.0 112.881 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 51.9 m -77.51 -35.2 53.74 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.664 0.786 . . . . 0.0 111.92 175.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -81.22 -23.46 38.09 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.94 -47.05 96.87 Favored Pre-proline 0 N--CA 1.482 1.126 0 CA-C-N 120.305 1.411 . . . . 0.0 112.338 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.3 -34.95 14.98 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 122.065 1.773 . . . . 0.0 113.612 172.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -66.0 -32.06 73.33 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.625 -1.297 . . . . 0.0 113.539 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.91 -28.31 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 61.5 mt -69.55 -49.53 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.883 0.873 . . . . 0.0 109.8 172.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.39 -53.52 56.41 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.712 0.805 . . . . 0.0 111.208 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -62.56 -26.41 68.56 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.073 -1.017 . . . . 0.0 113.068 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.75 -48.01 17.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.187 0.903 . . . . 0.0 112.561 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -25.2 67.1 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 121.059 1.754 . . . . 0.0 113.653 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -73.45 -28.02 61.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.725 1.61 . . . . 0.0 114.478 168.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -135.01 63.65 58.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.122 1.369 . . . . 0.0 110.735 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -63.82 -12.42 31.6 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.403 2.735 . . . . 0.0 115.871 -168.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.16 -17.01 38.5 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.348 1.459 . . . . 0.0 113.447 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -74.32 161.38 29.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.536 1.135 . . . . 0.0 111.985 -173.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -75.02 159.99 31.08 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.68 -0.638 . . . . 0.0 109.772 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.9 tp -70.8 -62.91 1.22 Allowed 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.586 -0.696 . . . . 0.0 112.257 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -61.52 -24.0 66.31 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 -167.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.7 t -57.46 -23.68 51.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.742 -0.599 . . . . 0.0 112.066 172.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -63.85 -3.46 2.46 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 119.789 -1.819 . . . . 0.0 114.5 174.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -35.38 63.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.235 1.379 . . . . 0.0 111.396 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -33.56 75.89 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -167.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -67.53 -27.22 66.79 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.541 1.937 . . . . 0.0 115.053 172.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.581 0 C-N-CA 125.102 1.361 . . . . 0.0 113.845 -167.787 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.408 ' HB3' ' HE3' ' B' ' 98' ' ' LYS . 23.3 mm-40 . . . . . 0 N--CA 1.469 0.49 0 CA-C-O 118.939 -0.553 . . . . 0.0 111.475 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t 97.78 106.52 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 129.647 3.179 . . . . 0.0 114.682 168.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.49 -31.0 70.97 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.708 -1.245 . . . . 0.0 111.347 170.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 9.1 mtmt -63.65 -25.08 68.05 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.449 1.5 . . . . 0.0 114.366 175.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.09 5.85 28.33 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.829 1.252 . . . . 0.0 113.356 175.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 41.4 ttm -62.03 125.31 23.43 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.656 -1.277 . . . . 0.0 109.922 173.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -78.57 155.92 29.42 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.842 -1.161 . . . . 0.0 110.187 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.63 -35.71 78.66 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.588 -1.32 . . . . 0.0 112.84 -174.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -61.69 -35.03 76.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 172.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -77.09 -37.38 54.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.653 1.181 . . . . 0.0 111.342 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -60.49 -49.91 75.65 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.619 -0.675 . . . . 0.0 112.378 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.5 pt -69.49 -1.68 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 124.394 1.078 . . . . 0.0 112.663 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -110.0 -12.27 14.55 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.522 1.529 . . . . 0.0 113.897 174.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.25 163.08 25.81 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 121.02 -1.05 . . . . 0.0 110.5 169.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -66.1 131.18 94.42 Favored Pre-proline 0 N--CA 1.483 1.192 0 O-C-N 120.745 -1.222 . . . . 0.0 112.05 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -61.39 -16.3 46.37 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.459 2.772 . . . . 0.0 115.415 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -56.93 -61.74 2.23 Favored 'General case' 0 C--N 1.35 0.61 0 C-N-CA 125.983 1.713 . . . . 0.0 108.814 168.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.44 -7.74 59.63 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 86.5 mtp -58.86 -37.0 75.52 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 120.403 1.456 . . . . 0.0 112.859 171.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.9 m -62.04 -55.96 36.06 Favored Pre-proline 0 N--CA 1.486 1.344 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -56.21 -39.05 93.72 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.265 2.643 . . . . 0.0 112.885 169.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 99.1 t -60.39 -42.84 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 120.033 -1.667 . . . . 0.0 111.969 175.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.34 -41.98 79.97 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.082 0.953 . . . . 0.0 110.962 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . 0.267 0.0 OUTLIER -73.34 -41.58 63.3 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 115.974 -1.965 . . . . 0.0 111.404 177.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.484 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 0.3 OUTLIER -65.58 -25.22 67.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.644 2.474 . . . . 0.0 113.85 175.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -67.04 -45.52 77.17 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.808 -0.557 . . . . 0.0 111.144 168.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 113.734 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 68.3 mt -64.57 -19.24 65.53 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.143 0.977 . . . . 0.0 112.954 175.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.5 m -89.15 -27.63 20.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.529 1.932 . . . . 0.0 112.323 173.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -83.45 -33.98 25.54 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 120.814 -1.178 . . . . 0.0 111.823 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.52 -42.76 89.76 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-O 117.227 -1.368 . . . . 0.0 113.535 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.13 -39.77 7.25 Favored 'Trans proline' 0 C--N 1.35 0.654 0 CA-C-N 122.571 1.954 . . . . 0.0 112.845 169.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -62.94 -38.81 92.53 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.625 1.557 . . . . 0.0 113.461 -176.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.0 m -70.41 -19.54 22.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.372 0.669 . . . . 0.0 112.491 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.8 mt -81.36 -47.99 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.316 -0.865 . . . . 0.0 109.933 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.84 -37.22 78.64 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.101 0.96 . . . . 0.0 112.008 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -68.62 -26.23 65.25 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.695 0.679 . . . . 0.0 111.758 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.0 m -77.65 -46.74 21.11 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.234 -0.916 . . . . 0.0 112.89 174.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -29.17 67.95 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 120.799 1.636 . . . . 0.0 114.166 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.66 -27.76 55.72 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -135.16 74.31 62.59 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.996 1.318 . . . . 0.0 112.073 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -59.03 -9.66 8.39 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 124.36 3.373 . . . . 0.0 117.371 -177.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -82.21 -22.11 36.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.981 1.312 . . . . 0.0 113.139 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? -68.9 157.7 36.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.3 1.04 . . . . 0.0 111.7 -174.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -75.86 152.39 37.21 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 169.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.5 -39.92 81.1 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.015 -1.053 . . . . 0.0 113.087 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.2 m-85 -86.68 -19.28 29.46 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -58.97 -23.46 61.7 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.318 -0.864 . . . . 0.0 111.671 170.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -58.19 -15.81 11.27 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.761 -1.837 . . . . 0.0 112.902 171.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.3 tptt -58.58 -35.28 72.15 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.045 -1.034 . . . . 0.0 112.597 168.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.16 -26.03 67.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.714 0.806 . . . . 0.0 112.208 -169.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -68.48 -30.21 69.0 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.894 2.078 . . . . 0.0 114.233 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.784 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -165.194 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.2 t -97.84 98.36 9.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 120.948 -1.095 . . . . 0.0 113.89 -166.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.52 62.79 Favored 'General case' 0 CA--C 1.555 1.164 0 O-C-N 120.771 -1.205 . . . . 0.0 110.815 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt -59.7 -30.78 69.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.988 2.115 . . . . 0.0 115.03 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -117.52 12.69 14.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.837 1.255 . . . . 0.0 113.107 -175.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 54.4 ttm -60.88 119.7 8.74 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.002 -1.061 . . . . 0.0 108.949 169.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -75.95 156.42 34.19 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.115 -0.99 . . . . 0.0 110.422 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -33.19 73.86 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.486 -1.384 . . . . 0.0 112.957 -172.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -65.75 -32.87 74.66 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.153 0.888 . . . . 0.0 112.865 173.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -77.41 -35.6 54.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.274 1.43 . . . . 0.0 111.17 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.51 -51.36 65.83 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.307 1.043 . . . . 0.0 112.411 175.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.9 pt -68.01 -4.03 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -103.01 -11.25 18.3 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.088 1.755 . . . . 0.0 114.182 170.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.17 157.61 37.31 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.983 1.265 . . . . 0.0 110.748 171.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . 0.262 0.1 OUTLIER -73.37 146.51 86.61 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -169.66 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -71.84 -10.55 26.51 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.865 1.71 . . . . 0.0 114.717 -177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' A' ' 3' ' ' GLU . 5.8 mptt -67.81 -55.44 12.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.876 1.216 . . . . 0.0 108.572 167.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.65 -13.96 52.98 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.9 mmt -47.69 -43.43 26.55 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.742 1.156 . . . . 0.0 112.581 171.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -61.3 -55.31 44.77 Favored Pre-proline 0 N--CA 1.481 1.111 0 C-N-CA 124.535 1.134 . . . . 0.0 113.606 -171.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . 0.434 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 14.0 Cg_endo -54.7 -47.4 26.92 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.471 2.781 . . . . 0.0 114.513 171.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.7 p -70.17 -34.54 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 120.574 -1.329 . . . . 0.0 113.095 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.61 -25.21 67.28 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.671 0.788 . . . . 0.0 111.746 173.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.484 ' CG ' ' CZ2' ' A' ' 27' ' ' TRP . 62.6 t90 -80.78 -50.27 10.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.436 1.017 . . . . 0.0 111.254 168.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -50.45 -44.37 55.47 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 121.696 0.76 . . . . 0.0 112.258 -172.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -64.47 -45.36 87.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.317 1.047 . . . . 0.0 112.045 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 C-N-CA 125.072 1.349 . . . . 0.0 113.012 -171.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -32.64 67.51 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 59.3 m -78.57 -36.04 45.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.701 0.8 . . . . 0.0 111.796 175.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -81.42 -32.96 32.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 117.428 -1.273 . . . . 0.0 114.421 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -48.11 -47.92 64.75 Favored Pre-proline 0 N--CA 1.482 1.157 0 CA-C-N 120.667 1.576 . . . . 0.0 113.175 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.92 -32.26 29.29 Favored 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 122.116 1.791 . . . . 0.0 113.811 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -65.2 -30.78 71.71 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.584 -1.322 . . . . 0.0 113.456 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.55 -31.76 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.285 0.493 . . . . 0.0 111.267 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -71.84 -50.77 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.564 1.146 . . . . 0.0 109.847 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.85 -39.96 82.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.414 0.686 . . . . 0.0 112.453 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -71.43 -27.44 63.29 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 118.828 0.74 . . . . 0.0 112.725 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -73.84 -47.99 34.44 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.403 -0.811 . . . . 0.0 112.478 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -26.79 67.82 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 120.359 1.436 . . . . 0.0 114.832 -178.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -80.67 -16.93 52.75 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -137.78 65.34 45.91 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 125.425 1.49 . . . . 0.0 111.463 174.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -64.12 -11.59 28.33 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.856 3.037 . . . . 0.0 115.923 -169.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -83.99 -17.1 41.62 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.014 1.325 . . . . 0.0 113.328 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -74.01 158.95 33.39 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.615 1.166 . . . . 0.0 111.545 -174.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.63 154.05 27.61 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.674 -0.641 . . . . 0.0 110.094 172.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -66.3 -44.9 82.18 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.24 -0.913 . . . . 0.0 113.044 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -77.55 -19.77 55.19 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -169.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 12.6 t -64.45 -16.4 62.36 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.738 -1.226 . . . . 0.0 112.412 169.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -67.56 -2.97 7.47 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.348 -2.095 . . . . 0.0 113.499 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -27.95 35.71 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.28 1.432 . . . . 0.0 112.293 167.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -64.36 -35.44 80.89 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.899 1.28 . . . . 0.0 112.049 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -72.1 -28.35 63.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.445 1.898 . . . . 0.0 115.403 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.79 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -166.673 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.443 -0.805 0 N-CA-C 103.614 -2.735 . . . . 0.0 103.614 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 m -94.9 87.72 5.06 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 125.331 1.452 . . . . 0.0 112.458 -163.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.29 -34.55 70.66 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 121.026 1.739 . . . . 0.0 110.706 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -20.52 62.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.72 2.408 . . . . 0.0 113.969 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -125.16 18.35 8.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.338 1.455 . . . . 0.0 112.145 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.7 ttm -60.62 119.67 8.55 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 169.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.68 154.8 36.29 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.069 -1.02 . . . . 0.0 109.458 -178.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.4 -34.62 75.66 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.466 -1.396 . . . . 0.0 112.951 -173.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -63.06 -34.62 77.98 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 172.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -76.14 -37.84 57.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.225 1.41 . . . . 0.0 111.253 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -62.14 -48.69 78.98 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.207 -0.933 . . . . 0.0 112.343 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.0 pt -70.35 -2.22 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 C-N-CA 123.671 0.788 . . . . 0.0 112.672 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -107.62 -15.33 14.61 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.86 1.664 . . . . 0.0 113.684 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.24 159.13 24.42 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.02 -1.05 . . . . 0.0 110.261 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.519 HD22 ' HD3' ' A' ' 19' ' ' LYS . 47.9 t-20 -67.01 128.09 93.75 Favored Pre-proline 0 N--CA 1.478 0.961 0 O-C-N 121.269 -0.894 . . . . 0.0 109.346 177.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -65.68 -20.72 59.47 Favored 'Trans proline' 0 N--CA 1.444 -1.397 0 C-N-CA 122.48 2.12 . . . . 0.0 111.636 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.519 ' HD3' HD22 ' A' ' 17' ' ' ASN . 4.8 mptt -48.79 -52.44 23.93 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 120.273 1.397 . . . . 0.0 108.697 169.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.66 0.04 40.45 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 31.6 mtt -65.89 -49.71 67.09 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 120.121 1.328 . . . . 0.0 112.199 173.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.25 -54.69 11.22 Favored Pre-proline 0 N--CA 1.49 1.564 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -176.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -60.05 -42.38 44.46 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.324 2.016 . . . . 0.0 113.725 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.0 t -63.2 -45.82 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.336 0.971 . . . . 0.0 111.023 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.61 91.13 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.71 1.204 . . . . 0.0 111.109 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 73.8 t90 -68.87 -52.99 23.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 117.794 -1.098 . . . . 0.0 112.651 170.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -41.73 61.37 Favored 'General case' 0 C--N 1.347 0.486 0 CA-C-O 122.428 1.109 . . . . 0.0 111.491 -174.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -66.18 -44.29 84.42 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.488 1.515 . . . . 0.0 112.143 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.468 0.459 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.5 p30 . . . . . 0 N--CA 1.469 0.475 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.97 -27.69 68.34 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.773 1.169 . . . . 0.0 111.963 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.0 m -74.55 -36.99 63.12 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.701 0.4 . . . . 0.0 110.33 169.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -84.09 -27.24 28.38 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -174.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.94 -41.02 77.1 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 121.212 1.824 . . . . 0.0 112.489 176.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.48 -38.0 2.82 Favored 'Trans proline' 0 C--N 1.353 0.777 0 CA-C-N 122.301 1.858 . . . . 0.0 113.432 168.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -66.95 -30.68 70.88 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.509 -1.37 . . . . 0.0 113.802 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.9 m -70.47 -20.98 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.097 0.862 . . . . 0.0 112.556 173.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 mt -81.78 -50.73 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 O-C-N 121.48 -0.763 . . . . 0.0 110.242 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.38 -41.81 85.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.835 0.854 . . . . 0.0 111.747 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -70.89 -22.75 62.24 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.994 -1.066 . . . . 0.0 111.725 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.5 m -79.44 -45.25 19.8 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.498 172.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -27.49 68.89 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.825 1.648 . . . . 0.0 113.761 173.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -69.15 -38.15 78.63 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 168.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -128.74 68.44 78.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.791 1.236 . . . . 0.0 112.143 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -55.59 -15.8 13.09 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.471 2.781 . . . . 0.0 115.883 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -80.14 -25.05 40.03 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.918 1.687 . . . . 0.0 113.268 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -75.55 162.89 27.9 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.07 1.348 . . . . 0.0 112.186 -170.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -77.34 150.6 35.17 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.584 -0.697 . . . . 0.0 109.175 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.7 tp -67.28 -33.85 76.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -88.78 -22.59 23.2 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -169.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.7 t -59.74 -21.09 60.23 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.508 -0.745 . . . . 0.0 111.842 169.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -58.57 -14.62 8.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 119.529 -1.982 . . . . 0.0 113.747 171.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -34.33 72.7 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.101 1.319 . . . . 0.0 111.845 166.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -25.51 66.57 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.663 0.744 . . . . 0.0 112.447 -170.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -66.65 -33.85 76.57 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.602 1.961 . . . . 0.0 113.938 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -165.458 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.272 9.6 mt-10 . . . . . 0 CA--C 1.558 1.276 0 CA-C-O 121.913 0.863 . . . . 0.0 109.041 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' SER . . . . . 0.431 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 37.1 t -129.33 113.18 14.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.982 1.713 . . . . 0.0 113.804 -169.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.34 -32.59 72.48 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 119.702 -1.874 . . . . 0.0 111.354 169.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -62.18 -24.16 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.814 2.045 . . . . 0.0 114.048 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -115.64 11.43 15.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.368 1.467 . . . . 0.0 113.369 176.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 51.3 ttm -62.88 125.44 23.97 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.644 -1.285 . . . . 0.0 109.939 171.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 155.66 31.14 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.04 -1.038 . . . . 0.0 110.487 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.8 -32.01 73.5 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.163 -1.585 . . . . 0.0 113.186 -172.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.44 -30.94 71.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.804 0.729 . . . . 0.0 112.663 171.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -81.53 -33.88 31.52 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.859 1.664 . . . . 0.0 111.32 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -64.12 -48.51 75.8 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.854 0.861 . . . . 0.0 112.987 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.1 pt -68.9 -4.12 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 176.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.98 -11.48 16.64 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.222 1.809 . . . . 0.0 114.081 172.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 158.41 36.2 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.928 1.24 . . . . 0.0 110.856 175.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -64.45 132.88 95.5 Favored Pre-proline 0 CA--C 1.551 1.003 0 O-C-N 121.246 -0.909 . . . . 0.0 111.871 -179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -63.81 -15.03 46.58 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.921 2.414 . . . . 0.0 114.5 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -55.51 -67.22 0.3 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.325 1.45 . . . . 0.0 108.868 167.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.91 -14.35 60.64 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 33.3 ttm -56.48 -34.56 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.882 -1.136 . . . . 0.0 113.081 175.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 41.5 m -63.16 -58.15 17.45 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.42 -39.11 92.83 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 123.486 2.791 . . . . 0.0 112.469 169.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 68.9 t -60.74 -43.69 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 120.059 -1.651 . . . . 0.0 111.478 176.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.18 -40.01 86.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.461 -0.78 . . . . 0.0 111.554 -175.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . . . . . . . . 0.276 0.0 OUTLIER -74.61 -42.52 58.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 116.674 -1.631 . . . . 0.0 111.021 175.042 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.497 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -65.84 -22.5 66.55 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 122.353 2.342 . . . . 0.0 114.15 176.907 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 3.9 ttp -76.3 -49.45 16.93 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.387 1.075 . . . . 0.0 111.263 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 CA--C 1.544 0.73 0 C-N-CA 123.649 0.779 . . . . 0.0 112.293 -175.441 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 . . . . . 0 N--CA 1.466 0.342 0 CA-C-O 119.08 -0.486 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 97.6 mt -57.17 -30.58 64.61 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.272 0.942 . . . . 0.0 112.584 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 43.7 m -79.21 -36.73 39.67 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.695 0.798 . . . . 0.0 111.77 173.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -83.46 -29.74 27.78 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.67 -44.79 91.06 Favored Pre-proline 0 CA--C 1.553 1.069 0 CA-C-N 120.53 1.514 . . . . 0.0 112.526 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.95 -34.79 10.12 Favored 'Trans proline' 0 C--N 1.352 0.755 0 CA-C-N 122.363 1.88 . . . . 0.0 113.561 171.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -65.6 -33.6 76.27 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.392 -1.442 . . . . 0.0 113.562 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.03 -28.59 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.562 0.619 . . . . 0.0 111.792 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.7 mt -71.31 -48.22 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.5 171.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -54.92 -44.89 74.63 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.15 0.98 . . . . 0.0 111.66 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.57 -32.58 74.25 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.436 -0.79 . . . . 0.0 112.383 -178.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.77 -47.1 61.35 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.443 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.79 -29.98 67.42 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.568 1.531 . . . . 0.0 114.512 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 24.6 pttt -78.69 -23.59 45.51 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -134.64 73.22 68.05 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 125.017 1.327 . . . . 0.0 111.91 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -61.04 -12.71 23.93 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.705 2.937 . . . . 0.0 117.208 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -80.3 -21.52 42.52 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.587 1.155 . . . . 0.0 113.22 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -63.56 152.73 37.87 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.766 0.827 . . . . 0.0 111.795 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -85.97 132.17 34.13 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 66.8 tp -49.8 -43.51 48.58 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -168.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -75.93 -7.9 55.67 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.852 -1.155 . . . . 0.0 113.982 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 58.8 p -57.54 -25.98 60.72 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.343 -1.473 . . . . 0.0 111.38 168.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -70.76 -1.99 13.27 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.794 1.237 . . . . 0.0 113.914 177.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -32.44 50.87 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.65 1.18 . . . . 0.0 111.611 166.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -66.31 -28.5 68.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.506 1.122 . . . . 0.0 112.887 -168.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -73.56 -30.07 62.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.693 1.997 . . . . 0.0 115.757 169.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 124.491 1.116 . . . . 0.0 113.856 -167.121 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.446 -0.67 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.1 t -105.06 108.89 20.65 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 120.765 -1.209 . . . . 0.0 112.66 -166.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.27 -29.8 71.06 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.796 -1.19 . . . . 0.0 111.209 170.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 mtmt -60.25 -44.62 95.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.527 1.131 . . . . 0.0 112.281 175.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -99.33 15.02 27.59 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.807 1.243 . . . . 0.0 113.982 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 57.2 ttm -60.78 126.14 26.3 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -78.57 154.75 30.1 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.288 -1.508 . . . . 0.0 110.491 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.51 -34.0 74.76 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.314 -1.491 . . . . 0.0 112.968 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -62.1 -31.61 72.09 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.791 0.836 . . . . 0.0 113.251 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -80.49 -36.03 33.93 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.402 1.481 . . . . 0.0 111.348 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -59.86 -48.85 80.01 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.354 -0.841 . . . . 0.0 111.981 175.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.0 pt -71.51 -2.11 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 125.056 1.342 . . . . 0.0 113.246 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.64 -13.02 16.11 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.343 1.457 . . . . 0.0 113.155 170.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.82 158.6 35.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.313 1.045 . . . . 0.0 111.31 175.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -64.65 139.7 97.83 Favored Pre-proline 0 N--CA 1.48 1.026 0 C-N-CA 123.719 0.808 . . . . 0.0 112.443 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . 0.284 12.1 Cg_exo -78.39 -9.7 16.21 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 CA-C-N 120.809 1.325 . . . . 0.0 114.31 -174.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -66.54 -54.22 26.11 Favored 'General case' 0 C--N 1.356 0.867 0 CA-C-N 120.338 1.426 . . . . 0.0 107.521 166.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.16 -5.92 55.32 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.5 mtt -58.64 -51.84 68.23 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.351 0.978 . . . . 0.0 111.821 170.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.3 m -54.53 -49.82 88.85 Favored Pre-proline 0 N--CA 1.482 1.159 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -173.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.5 -45.95 37.29 Favored 'Trans proline' 0 N--CA 1.476 0.489 0 C-N-CA 123.227 2.618 . . . . 0.0 116.47 170.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.31 -41.28 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 120.841 -1.162 . . . . 0.0 112.469 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.26 -27.96 67.68 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.371 1.068 . . . . 0.0 111.125 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 57.6 t90 -82.0 -51.13 8.35 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-O 117.189 -1.386 . . . . 0.0 113.103 170.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.9 t90 -62.96 -31.43 72.53 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 120.652 1.569 . . . . 0.0 110.797 -168.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 62.4 ttp -57.68 -51.88 67.73 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.041 1.336 . . . . 0.0 112.12 167.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 C-N-CA 125.374 1.47 . . . . 0.0 113.887 -175.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 . . . . . 0 N--CA 1.466 0.343 0 CA-C-O 119.696 -0.192 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 81.6 mt -63.56 -26.05 68.52 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.058 -1.026 . . . . 0.0 112.501 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.3 m -75.27 -38.75 60.32 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.015 0.526 . . . . 0.0 110.958 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -86.91 -27.91 23.09 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.041 -0.981 . . . . 0.0 113.628 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.6 mp -51.78 -43.63 88.83 Favored Pre-proline 0 CA--C 1.551 0.998 0 CA-C-N 120.641 1.564 . . . . 0.0 113.005 175.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.21 -39.56 7.4 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 122.054 1.769 . . . . 0.0 113.555 169.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.64 -37.52 87.65 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.431 1.014 . . . . 0.0 112.909 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.49 -26.23 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 177.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.6 mt -73.74 -52.47 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 121.776 -0.578 . . . . 0.0 110.195 173.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -55.45 -49.27 72.89 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.611 0.765 . . . . 0.0 110.502 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -65.45 -25.51 67.55 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.514 -0.741 . . . . 0.0 112.019 -176.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.67 -47.98 15.91 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.125 0.875 . . . . 0.0 112.295 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -26.68 68.4 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.662 1.574 . . . . 0.0 113.748 174.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 mtpp -72.75 -29.03 62.99 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.778 1.631 . . . . 0.0 114.492 169.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -135.04 66.79 68.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.138 1.375 . . . . 0.0 112.397 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -57.65 -13.55 14.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 123.514 2.809 . . . . 0.0 116.914 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -83.97 -21.06 31.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.226 1.41 . . . . 0.0 113.762 -178.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -69.06 156.0 39.39 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.928 0.891 . . . . 0.0 111.775 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -92.84 122.75 35.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.7 tp -42.69 -52.9 4.74 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -165.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -68.32 -8.11 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -173.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -55.69 -28.16 54.12 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 121.021 -1.049 . . . . 0.0 111.294 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -71.99 -1.22 13.77 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.642 1.577 . . . . 0.0 114.336 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -31.61 25.89 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.183 1.356 . . . . 0.0 110.936 166.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.53 -26.65 64.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.937 0.895 . . . . 0.0 111.909 -170.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -72.97 -28.99 62.73 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.553 1.541 . . . . 0.0 114.937 171.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.647 0 C-N-CA 125.165 1.386 . . . . 0.0 113.78 -167.854 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 . . . . . 0 CA--C 1.548 0.873 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.1 t -105.38 103.51 13.05 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 120.264 -1.523 . . . . 0.0 113.746 -164.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.21 -35.68 67.59 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.758 -1.214 . . . . 0.0 110.275 170.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -66.53 -20.61 66.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.398 2.279 . . . . 0.0 115.512 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -123.65 9.4 8.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.628 1.171 . . . . 0.0 113.213 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 27.9 ttm -61.4 134.04 56.47 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 120.552 -1.342 . . . . 0.0 109.858 169.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 9.3 p -71.81 169.85 14.88 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 121.948 0.88 . . . . 0.0 112.381 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.2 m -70.37 -38.68 74.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.933 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -63.78 -37.73 88.45 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.416 1.007 . . . . 0.0 112.37 173.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -73.12 -39.03 66.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.483 1.113 . . . . 0.0 111.598 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -61.5 -49.46 76.66 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.431 -0.793 . . . . 0.0 113.105 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.3 pt -68.41 -4.72 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 176.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -105.9 -10.75 16.48 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.282 1.833 . . . . 0.0 114.058 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 158.84 34.72 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.767 1.167 . . . . 0.0 110.887 176.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -58.11 134.21 84.18 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.186 0.995 . . . . 0.0 113.164 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.95 -16.86 32.49 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 122.693 2.262 . . . . 0.0 115.686 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -63.7 -49.23 73.93 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 121.003 1.729 . . . . 0.0 109.716 170.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.38 -16.03 38.58 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.4 ttm -54.6 -34.86 62.68 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.462 -1.399 . . . . 0.0 113.236 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 56.3 m -65.58 -57.38 14.61 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-O 117.535 -1.222 . . . . 0.0 112.911 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -52.79 -38.72 78.25 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.881 3.054 . . . . 0.0 114.444 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 58.4 t -62.83 -52.61 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 121.9 -0.5 . . . . 0.0 111.286 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.94 -40.99 95.37 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.291 1.037 . . . . 0.0 110.842 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 82.5 t90 -68.19 -50.04 56.89 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.577 -1.201 . . . . 0.0 112.626 175.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.414 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.2 t90 -67.77 -29.91 69.23 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 120.746 1.612 . . . . 0.0 111.56 -168.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.8 tmm? -60.41 -48.5 81.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.578 1.151 . . . . 0.0 111.577 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.545 0.78 0 C-N-CA 124.89 1.276 . . . . 0.0 113.18 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 119.802 -0.142 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -56.01 -32.61 64.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.748 0.819 . . . . 0.0 112.265 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 26.1 m -80.86 -38.53 27.98 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.648 0.779 . . . . 0.0 112.287 173.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -78.0 -31.83 50.84 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 117.321 -1.324 . . . . 0.0 114.452 -175.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.51 -46.37 90.55 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 121.2 1.818 . . . . 0.0 112.998 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.25 -38.54 8.77 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 121.941 1.729 . . . . 0.0 113.428 172.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -67.54 -31.73 72.02 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.746 -1.221 . . . . 0.0 113.773 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.3 -26.86 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 118.384 0.538 . . . . 0.0 111.994 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 39.7 mt -71.0 -50.18 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.701 0.8 . . . . 0.0 109.715 171.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.93 -45.48 82.7 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.759 0.824 . . . . 0.0 111.813 175.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.88 -24.87 65.28 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.653 -1.279 . . . . 0.0 112.299 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.9 -46.94 19.89 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.916 0.78 . . . . 0.0 112.207 176.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -26.19 68.04 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 120.363 1.438 . . . . 0.0 113.981 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -68.92 -31.1 69.77 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 168.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -133.05 63.83 68.27 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 124.872 1.269 . . . . 0.0 112.322 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -56.9 -20.03 34.43 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.166 2.578 . . . . 0.0 116.435 -171.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -80.2 -16.77 54.07 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.605 1.162 . . . . 0.0 113.283 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' B' ' 143' ' ' LYS . 10.0 mmpt? -74.25 165.89 24.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.612 1.165 . . . . 0.0 112.219 -172.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -80.46 151.57 29.21 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 49.2 tp -68.56 -38.97 81.21 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.2 -20.16 30.59 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -169.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.8 t -62.06 -16.47 52.23 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.048 -1.033 . . . . 0.0 112.127 171.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.5 -4.04 5.31 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 119.512 -1.992 . . . . 0.0 114.336 168.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.13 -28.35 35.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.293 1.437 . . . . 0.0 111.988 166.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.17 -35.47 81.19 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.175 1.39 . . . . 0.0 112.075 -174.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -70.78 -28.22 64.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.348 1.859 . . . . 0.0 114.948 173.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -167.598 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 118.55 -0.738 . . . . 0.0 112.681 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 93.75 104.4 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.982 2.913 . . . . 0.0 117.45 167.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.49 -29.06 68.83 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 119.855 -1.778 . . . . 0.0 112.306 169.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.431 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 7.7 mtmt -65.28 -30.85 71.75 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.145 1.378 . . . . 0.0 114.118 174.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -100.8 4.95 43.32 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.479 1.111 . . . . 0.0 113.077 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.9 ttm -63.89 139.83 58.81 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 119.604 1.093 . . . . 0.0 110.487 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.3 p -78.44 175.88 9.89 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.038 -1.038 . . . . 0.0 112.247 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.31 -39.72 53.36 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.702 171.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.78 -35.96 79.69 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.11 0.868 . . . . 0.0 112.23 171.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -75.72 -38.55 58.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.66 1.184 . . . . 0.0 111.948 176.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -57.5 -50.58 72.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 121.478 -0.764 . . . . 0.0 112.792 176.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.9 pt -68.26 -4.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 C-N-CA 124.094 0.958 . . . . 0.0 112.519 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -106.98 -13.61 15.16 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.337 1.455 . . . . 0.0 114.291 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.73 163.77 27.18 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 120.892 -1.13 . . . . 0.0 111.048 173.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 t-20 -65.07 131.52 95.19 Favored Pre-proline 0 N--CA 1.484 1.23 0 O-C-N 120.683 -1.261 . . . . 0.0 112.531 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.94 -16.16 37.08 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.82 3.014 . . . . 0.0 115.669 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.9 mptt -58.17 -65.49 0.64 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 125.776 1.631 . . . . 0.0 108.899 167.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.02 -9.61 59.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 83.7 mtp -58.1 -35.97 72.2 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.797 1.181 . . . . 0.0 112.749 171.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.5 m -64.19 -55.95 27.56 Favored Pre-proline 0 N--CA 1.484 1.236 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.23 -35.31 95.39 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.325 2.683 . . . . 0.0 114.224 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.1 t -63.1 -52.36 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.392 0.677 . . . . 0.0 111.617 173.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.97 -39.32 91.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.045 1.338 . . . . 0.0 110.708 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 72.4 t90 -67.74 -51.86 44.3 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-O 116.944 -1.503 . . . . 0.0 112.644 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.455 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.4 t90 -67.28 -25.05 65.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.973 1.715 . . . . 0.0 111.7 -169.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -67.66 -46.19 73.1 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.448 1.099 . . . . 0.0 111.702 169.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.57 -26.89 68.82 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.316 -0.865 . . . . 0.0 111.794 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.4 m -77.91 -36.21 49.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.221 1.008 . . . . 0.0 111.502 171.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.99 -28.97 29.33 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.31 -39.69 73.61 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-O 117.176 -1.392 . . . . 0.0 112.78 177.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -73.98 -37.94 2.51 Favored 'Trans proline' 0 C--N 1.354 0.825 0 CA-C-N 122.307 1.859 . . . . 0.0 113.317 168.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -66.46 -32.41 73.75 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.486 -1.383 . . . . 0.0 113.683 -176.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.62 -17.31 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 mt -83.45 -52.82 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.416 1.087 . . . . 0.0 109.633 172.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -56.41 -49.9 73.19 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.027 0.931 . . . . 0.0 110.735 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -62.34 -24.77 67.53 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.438 -0.789 . . . . 0.0 111.596 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.73 -47.39 14.03 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.397 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -27.87 69.58 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.848 1.658 . . . . 0.0 113.696 172.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -73.02 -30.52 63.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.787 1.635 . . . . 0.0 115.115 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -131.59 66.62 78.64 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.227 1.411 . . . . 0.0 110.479 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -60.57 -14.36 30.5 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.592 2.861 . . . . 0.0 114.646 -174.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -79.12 -26.29 42.88 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.158 1.783 . . . . 0.0 112.685 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -69.17 162.71 26.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.65 1.18 . . . . 0.0 112.624 -169.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -94.82 131.4 40.74 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.2 tp -52.29 -35.81 51.28 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -166.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.267 5.0 m-85 -82.55 -5.45 58.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.351 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 60.5 p -60.49 -27.81 67.87 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 120.168 -1.583 . . . . 0.0 111.357 168.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -70.6 -4.11 21.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.512 1.525 . . . . 0.0 114.114 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -32.2 40.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.994 1.717 . . . . 0.0 111.316 169.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -72.7 -25.45 61.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.089 1.356 . . . . 0.0 112.176 -171.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -76.19 -31.59 58.55 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -167.761 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 21.0 t -94.26 99.51 11.74 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 120.672 -1.268 . . . . 0.0 113.689 -166.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.32 -33.6 63.45 Favored 'General case' 0 CA--C 1.554 1.123 0 O-C-N 120.827 -1.17 . . . . 0.0 110.911 169.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.431 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 13.5 mtmt -62.54 -37.77 87.41 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.679 1.992 . . . . 0.0 114.199 176.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -106.63 12.82 28.91 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.927 1.291 . . . . 0.0 112.672 -178.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 60.2 ttm -58.48 132.17 52.93 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 121.108 -0.995 . . . . 0.0 108.5 169.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 11.7 p -74.56 172.35 12.17 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.218 -0.926 . . . . 0.0 111.765 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.58 -36.22 73.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.94 170.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -63.67 -35.89 82.05 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.361 0.982 . . . . 0.0 112.462 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.01 -34.75 50.53 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.921 1.288 . . . . 0.0 111.885 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -68.7 -37.13 79.29 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.964 -1.085 . . . . 0.0 113.52 173.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.4 pt -77.64 3.8 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 O-C-N 120.844 -1.16 . . . . 0.0 112.026 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -120.03 -32.24 4.24 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -177.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.42 162.81 14.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.231 1.832 . . . . 0.0 111.906 172.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . 0.427 HD22 ' CD ' ' B' ' 98' ' ' LYS . 48.5 t-20 -63.69 132.22 95.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.805 -168.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.0 -22.22 29.92 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.029 3.153 . . . . 0.0 115.378 176.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . 0.427 ' CD ' HD22 ' B' ' 96' ' ' ASN . 14.6 mttt -56.64 -59.83 4.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.125 1.77 . . . . 0.0 109.365 167.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.75 -14.74 47.35 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 30.5 ttm -53.92 -36.18 62.48 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.947 0.899 . . . . 0.0 111.197 168.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 28.4 m -65.97 -57.65 13.01 Favored Pre-proline 0 N--CA 1.479 0.986 0 CA-C-O 117.862 -1.066 . . . . 0.0 112.818 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -51.23 -41.79 56.68 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.983 3.122 . . . . 0.0 115.188 170.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.92 -37.8 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.606 1.094 . . . . 0.0 113.289 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.16 -33.91 76.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.234 0.613 . . . . 0.0 111.047 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 84.6 t90 -75.91 -50.38 15.17 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-O 117.722 -1.132 . . . . 0.0 112.349 175.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.436 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 1.5 t90 -67.06 -25.51 66.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 117.924 -1.51 . . . . 0.0 111.16 -170.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 54.9 ttp -60.97 -53.36 58.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.638 1.175 . . . . 0.0 111.319 168.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.846 0 C-N-CA 124.775 1.23 . . . . 0.0 112.411 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 119.421 -0.323 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.9 mt -57.17 -27.13 61.64 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.756 0.707 . . . . 0.0 112.624 174.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.4 m -81.08 -37.84 28.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.492 1.117 . . . . 0.0 111.783 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -84.47 -29.95 25.64 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.895 1.442 . . . . 0.0 114.895 -175.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.15 -44.51 98.6 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 120.489 1.495 . . . . 0.0 112.111 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.27 -35.64 18.34 Favored 'Trans proline' 0 C--N 1.353 0.781 0 CA-C-N 122.205 1.823 . . . . 0.0 113.718 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.76 -38.66 91.45 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.453 1.479 . . . . 0.0 112.869 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 m -69.09 -29.19 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.41 -52.15 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.08 0.952 . . . . 0.0 109.9 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -58.19 -42.83 86.97 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.814 0.846 . . . . 0.0 112.386 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -68.32 -27.64 66.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.809 0.844 . . . . 0.0 112.454 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.46 -48.92 15.93 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.364 -0.835 . . . . 0.0 112.906 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -24.93 66.06 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -75.42 -23.36 56.99 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 170.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -138.6 71.95 43.59 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.603 1.161 . . . . 0.0 111.997 172.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -59.14 -16.96 36.14 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.615 2.877 . . . . 0.0 116.772 -172.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -78.33 -16.98 57.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.596 1.158 . . . . 0.0 113.32 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -71.91 164.96 25.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.017 1.327 . . . . 0.0 111.717 -174.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -80.7 159.18 25.34 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 110.366 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.58 -64.82 0.91 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.775 -0.578 . . . . 0.0 112.395 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.431 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 2.7 m-85 -62.49 -21.3 65.38 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -167.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.8 t -55.87 -26.17 45.75 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.477 -0.764 . . . . 0.0 112.31 171.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -64.71 -2.29 2.39 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.823 -1.798 . . . . 0.0 113.748 173.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -72.28 -34.74 68.42 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.668 1.122 . . . . 0.0 111.839 165.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.52 -32.95 73.01 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -167.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -73.55 -28.02 61.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.127 2.171 . . . . 0.0 115.706 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -165.857 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 pm0 . . . . . 0 N--CA 1.442 -0.828 0 CA-C-O 123.263 1.506 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.484 ' H ' ' HG3' ' B' ' 98' ' ' LYS . 26.8 t -148.4 88.5 1.64 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 113.853 -1.522 . . . . 0.0 109.335 167.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.69 -31.74 66.67 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.653 -1.279 . . . . 0.0 110.74 171.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.435 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 8.9 mttt -50.12 -49.55 51.44 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.602 1.961 . . . . 0.0 111.728 170.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -100.71 16.43 24.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.287 1.435 . . . . 0.0 113.842 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -55.83 124.13 16.52 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 167.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.5 t -75.48 153.12 37.73 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 120.9 -1.125 . . . . 0.0 110.141 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.23 -32.7 73.41 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.063 -1.648 . . . . 0.0 112.935 -175.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -64.93 -31.0 72.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.91 0.884 . . . . 0.0 112.606 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -77.96 -37.7 46.88 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.193 1.397 . . . . 0.0 111.556 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.98 -49.41 77.77 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.455 -0.778 . . . . 0.0 112.885 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.3 pt -68.42 -5.79 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.669 1.188 . . . . 0.0 113.152 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -110.6 -8.45 14.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.811 1.644 . . . . 0.0 113.74 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.92 159.54 32.65 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 121.057 -1.027 . . . . 0.0 110.329 175.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -65.43 128.65 93.98 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 121.19 -0.944 . . . . 0.0 111.837 -173.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.62 -15.56 12.66 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.777 2.985 . . . . 0.0 115.567 178.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -62.5 -72.41 0.13 Allowed 'General case' 0 C--N 1.349 0.557 0 C-N-CA 126.423 1.889 . . . . 0.0 109.463 166.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.51 -4.11 43.95 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -177.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.9 ttt -58.18 -39.95 80.22 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 112.92 170.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.263 20.1 m -66.21 -51.39 44.85 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -50.16 -45.12 34.92 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.453 2.768 . . . . 0.0 115.841 169.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 p -73.69 -39.0 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.204 0.911 . . . . 0.0 113.358 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.72 -26.3 68.61 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.197 0.999 . . . . 0.0 111.676 172.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 65.5 t90 -83.61 -51.78 7.01 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.378 171.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.453 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.9 t90 -66.02 -34.85 79.03 Favored 'General case' 0 C--N 1.348 0.521 0 CA-C-N 120.329 1.422 . . . . 0.0 112.026 -167.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -55.85 -38.82 70.58 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.694 1.198 . . . . 0.0 112.168 171.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 125.257 1.423 . . . . 0.0 112.853 -169.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.33 -29.29 68.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.591 0.756 . . . . 0.0 112.259 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.7 m -78.74 -34.05 46.1 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.871 1.268 . . . . 0.0 111.857 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -79.14 -26.56 42.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.466 -1.254 . . . . 0.0 113.139 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mm -53.74 -46.13 98.49 Favored Pre-proline 0 N--CA 1.479 0.976 0 CA-C-N 120.327 1.421 . . . . 0.0 112.76 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.22 -37.24 14.57 Favored 'Trans proline' 0 C--N 1.352 0.731 0 CA-C-N 121.701 1.643 . . . . 0.0 113.141 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.88 -37.3 85.76 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.829 -1.169 . . . . 0.0 113.364 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.72 -16.96 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.221 0.608 . . . . 0.0 112.582 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mt -85.12 -49.69 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 124.238 1.015 . . . . 0.0 110.232 171.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -57.47 -39.62 76.76 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.949 0.9 . . . . 0.0 111.758 176.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -71.38 -23.63 61.93 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.19 -0.943 . . . . 0.0 111.67 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -81.09 -44.2 18.34 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.051 -1.031 . . . . 0.0 112.151 175.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -27.4 69.28 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 120.549 1.522 . . . . 0.0 113.698 172.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -71.76 -35.79 70.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -126.98 62.2 50.77 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.876 1.27 . . . . 0.0 111.376 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.96 -17.15 10.28 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.707 3.605 . . . . 0.0 116.071 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -83.28 -22.9 32.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.589 1.555 . . . . 0.0 113.183 -176.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -68.53 159.24 32.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.077 0.951 . . . . 0.0 112.473 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -97.54 118.15 33.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 -175.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -43.24 -43.88 5.01 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -165.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CG ' ' HA ' ' A' ' 6' ' ' LYS 0.251 4.3 m-30 -72.01 -8.23 53.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 120.445 1.475 . . . . 0.0 114.06 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.2 p -58.74 -27.48 64.98 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 120.255 -1.528 . . . . 0.0 111.838 167.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -70.54 -11.67 61.08 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.581 -1.324 . . . . 0.0 112.664 177.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -68.8 -30.68 69.3 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.516 1.127 . . . . 0.0 112.057 169.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -69.41 -16.67 63.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 112.003 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -79.79 -26.37 40.62 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.266 2.226 . . . . 0.0 114.396 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -163.338 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t 102.79 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 129.525 3.13 . . . . 0.0 116.975 166.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.7 -39.73 68.47 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.391 -1.443 . . . . 0.0 111.287 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.437 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 4.4 ptpt -77.08 1.65 17.45 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -127.08 6.84 6.53 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.084 1.354 . . . . 0.0 112.64 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 33.4 ttm -62.2 137.43 58.25 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.778 -1.201 . . . . 0.0 110.046 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 22.2 p -74.18 167.51 21.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.124 0.964 . . . . 0.0 111.727 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.73 -36.28 73.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.826 170.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -63.12 -36.96 85.35 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.161 0.891 . . . . 0.0 112.58 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -75.86 -38.72 57.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.941 0.896 . . . . 0.0 111.874 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -59.94 -45.38 92.81 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.189 -0.944 . . . . 0.0 113.08 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -71.45 -0.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 118.89 0.768 . . . . 0.0 112.665 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -119.03 -14.77 9.33 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 126.331 1.853 . . . . 0.0 114.949 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.64 159.15 13.8 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.956 1.253 . . . . 0.0 111.234 173.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -73.31 130.7 83.96 Favored Pre-proline 0 N--CA 1.482 1.151 0 O-C-N 120.72 -1.238 . . . . 0.0 110.263 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -58.18 -26.93 78.35 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 121.69 1.593 . . . . 0.0 114.445 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . 0.484 ' HG3' ' H ' ' A' ' 4' ' ' SER . 6.5 mptt -56.7 -15.07 3.88 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 121.459 1.936 . . . . 0.0 114.604 175.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -123.38 21.37 9.51 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 122.791 2.541 . . . . 0.0 114.61 167.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 35.7 ttm -73.42 -57.84 3.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.44 1.496 . . . . 0.0 112.503 172.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.6 m -49.58 -52.35 51.11 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.35 -45.26 40.74 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.996 3.13 . . . . 0.0 115.792 172.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.2 p -75.63 -39.84 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 120.749 1.613 . . . . 0.0 112.785 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.82 -31.58 69.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.776 0.83 . . . . 0.0 111.252 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 37.5 t90 -83.06 -47.18 11.95 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.556 -1.211 . . . . 0.0 112.102 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.413 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -68.84 -24.1 64.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 121.208 1.822 . . . . 0.0 111.128 -170.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.09 -46.91 79.14 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.935 1.294 . . . . 0.0 111.51 169.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.6 mm? . . . . . 0 CA--C 1.548 0.872 0 C-N-CA 125.173 1.389 . . . . 0.0 113.187 173.359 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 76.0 mt -52.82 -34.91 56.03 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.264 1.025 . . . . 0.0 113.009 174.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 58.7 m -75.72 -33.15 60.29 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.375 0.67 . . . . 0.0 111.596 175.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -81.03 -25.1 37.43 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 179.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.1 mm -54.42 -44.35 98.75 Favored Pre-proline 0 CA--C 1.555 1.161 0 CA-C-N 120.187 1.358 . . . . 0.0 112.173 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.98 -34.38 10.59 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.821 1.686 . . . . 0.0 113.204 171.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -66.1 -32.39 73.82 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.659 -1.276 . . . . 0.0 113.604 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.09 -25.9 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.663 0.665 . . . . 0.0 112.481 173.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.5 mt -73.62 -53.06 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.797 0.839 . . . . 0.0 109.546 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.42 -44.21 84.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.935 0.894 . . . . 0.0 112.184 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -71.44 -24.48 62.03 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.99 -1.069 . . . . 0.0 112.172 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.88 -46.01 22.57 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.118 -0.989 . . . . 0.0 112.055 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -26.03 68.59 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 120.28 1.4 . . . . 0.0 113.778 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -72.85 -32.34 65.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 168.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -129.34 60.51 51.62 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.22 1.408 . . . . 0.0 111.11 -175.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -60.17 -17.07 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.747 2.965 . . . . 0.0 115.424 -169.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -80.39 -18.01 50.18 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.668 1.187 . . . . 0.0 113.355 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -71.79 165.97 22.99 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.252 1.021 . . . . 0.0 112.429 -172.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -92.49 130.82 38.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 55.0 tp -46.71 -34.51 5.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.271 1.828 . . . . 0.0 114.092 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.437 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.2 m-85 -84.66 -8.71 58.77 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.6 p -62.81 -25.59 68.32 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.564 -1.335 . . . . 0.0 111.391 168.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -71.5 -2.98 18.7 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.28 1.432 . . . . 0.0 114.204 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -32.17 41.35 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.942 1.297 . . . . 0.0 111.277 167.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -72.44 -31.04 65.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.639 1.176 . . . . 0.0 112.431 -169.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -67.82 -30.0 69.3 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.701 1.6 . . . . 0.0 114.662 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -167.28 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t 93.42 98.85 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.571 2.748 . . . . 0.0 117.217 165.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.27 -30.33 66.5 Favored 'General case' 0 CA--C 1.556 1.19 0 O-C-N 120.211 -1.556 . . . . 0.0 112.06 172.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.423 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 11.1 mtmt -64.91 -20.51 66.48 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.821 1.649 . . . . 0.0 114.869 173.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -114.5 7.36 16.17 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.035 1.334 . . . . 0.0 113.053 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -63.12 123.93 19.85 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.68 -1.263 . . . . 0.0 109.771 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.62 155.35 29.62 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.156 -0.965 . . . . 0.0 110.379 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -63.5 -33.46 75.64 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 120.247 -1.533 . . . . 0.0 113.291 -174.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.13 -32.99 73.64 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 171.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -78.93 -36.42 41.8 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.123 1.369 . . . . 0.0 111.774 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.09 -49.31 78.17 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.402 -0.811 . . . . 0.0 112.502 177.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -68.51 -2.54 2.03 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 124.743 1.217 . . . . 0.0 112.856 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -113.49 -11.1 13.12 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.872 1.669 . . . . 0.0 113.826 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.23 155.64 38.32 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 121.116 -0.99 . . . . 0.0 110.726 172.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -68.36 132.82 91.35 Favored Pre-proline 0 N--CA 1.48 1.043 0 O-C-N 121.052 -1.03 . . . . 0.0 111.231 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -45.49 -35.42 12.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.304 3.336 . . . . 0.0 114.466 175.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.7 mttt -61.2 -19.06 61.17 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -177.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -127.52 19.53 6.78 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.655 1.57 . . . . 0.0 114.207 166.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 47.6 mtp -65.79 -58.73 4.95 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.784 0.833 . . . . 0.0 111.961 168.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 m -40.96 -55.31 4.86 Favored Pre-proline 0 N--CA 1.494 1.755 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -58.04 -39.43 85.9 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 123.791 2.994 . . . . 0.0 115.806 175.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.8 -38.4 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.807 1.185 . . . . 0.0 112.632 174.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.96 -21.35 66.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.303 1.041 . . . . 0.0 111.573 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.452 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 70.9 t90 -92.36 -49.12 6.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 116.986 -1.483 . . . . 0.0 112.973 168.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -69.27 -22.87 63.79 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 121.744 2.065 . . . . 0.0 112.512 -169.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.0 tmm? -70.76 -34.42 71.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.327 -0.858 . . . . 0.0 111.592 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 C-N-CA 125.953 1.701 . . . . 0.0 111.99 -177.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 C--O 1.221 -0.418 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.97 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.76 -23.03 66.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.376 0.989 . . . . 0.0 111.433 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.0 m -79.43 -37.3 37.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.055 0.942 . . . . 0.0 111.529 169.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -85.96 -27.06 25.14 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.26 -42.07 89.46 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-N 120.455 1.48 . . . . 0.0 112.385 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.58 -37.79 6.79 Favored 'Trans proline' 0 C--N 1.355 0.911 0 CA-C-N 121.97 1.739 . . . . 0.0 113.186 169.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt -66.81 -32.67 74.1 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.225 -1.547 . . . . 0.0 113.839 -176.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.7 m -69.07 -20.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 119.011 0.823 . . . . 0.0 112.949 173.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.0 mt -83.95 -51.04 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.043 0.937 . . . . 0.0 110.023 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.45 -38.84 78.34 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.152 0.981 . . . . 0.0 111.969 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.94 -30.28 68.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.556 0.616 . . . . 0.0 111.305 177.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -76.62 -42.51 42.02 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 120.934 -1.104 . . . . 0.0 113.072 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.71 -29.62 68.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 120.877 1.671 . . . . 0.0 113.914 177.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG3' HD21 ' A' ' 61' ' ' ASN . 14.3 ptpt -80.11 -29.19 38.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.423 HD21 ' HG3' ' A' ' 60' ' ' LYS . 24.3 m-80 -129.81 70.74 82.13 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.521 1.528 . . . . 0.0 111.121 174.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -59.53 -11.74 15.02 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.859 3.706 . . . . 0.0 116.254 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -83.69 -21.48 32.37 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.355 1.462 . . . . 0.0 113.146 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -69.1 157.4 36.91 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.113 0.965 . . . . 0.0 111.49 -174.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -94.39 134.54 36.78 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.8 tp -51.85 -38.85 57.54 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -168.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.423 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 5.2 m-85 -79.6 -5.88 55.92 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.7 p -61.41 -27.58 68.64 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.043 -1.661 . . . . 0.0 110.948 167.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.41 -2.91 24.28 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.417 1.487 . . . . 0.0 113.487 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -31.48 37.53 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.548 1.539 . . . . 0.0 111.714 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -70.22 -26.66 63.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.742 1.217 . . . . 0.0 112.198 -171.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -79.34 -31.16 42.98 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.763 1.625 . . . . 0.0 115.056 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.545 0 C-N-CA 124.614 1.165 . . . . 0.0 113.602 -167.27 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.427 -1.616 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 20.2 m -137.03 56.53 1.79 Allowed 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 124.032 0.933 . . . . 0.0 109.26 168.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.68 -39.79 68.45 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.546 -1.347 . . . . 0.0 109.677 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.462 ' HA ' ' CD2' ' B' ' 146' ' ' TYR . 2.4 ptpt -68.18 -6.31 22.69 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.449 2.699 . . . . 0.0 116.527 175.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -138.42 18.4 2.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.495 1.518 . . . . 0.0 112.143 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 23.4 ttm -60.09 123.76 18.13 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 120.023 1.283 . . . . 0.0 108.143 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.8 t -76.6 152.15 36.0 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.065 -175.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.195 -1.566 . . . . 0.0 112.763 -170.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -32.42 71.92 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 119.34 0.973 . . . . 0.0 112.38 173.5 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.41 -37.3 63.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.538 1.535 . . . . 0.0 111.231 174.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -64.01 -49.75 71.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.652 1.181 . . . . 0.0 113.203 175.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.0 pt -68.66 -3.88 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 176.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -103.78 -10.13 18.51 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.073 1.749 . . . . 0.0 114.053 169.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.77 160.76 32.11 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.702 -1.249 . . . . 0.0 110.464 171.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . 0.424 HD22 ' HD2' ' B' ' 98' ' ' LYS . 53.8 t-20 -69.44 130.47 90.75 Favored Pre-proline 0 N--CA 1.481 1.122 0 O-C-N 121.376 -0.827 . . . . 0.0 111.942 -178.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.13 -19.95 35.79 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.57 2.847 . . . . 0.0 115.614 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . 0.424 ' HD2' HD22 ' B' ' 96' ' ' ASN . 33.8 mttt -55.81 -66.19 0.47 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.487 1.915 . . . . 0.0 110.386 168.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.37 -6.57 59.4 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.6 ttm -58.37 -38.02 76.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.97 -1.081 . . . . 0.0 111.313 168.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 63.3 m -60.48 -56.75 32.21 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 124.346 1.058 . . . . 0.0 112.598 -177.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -52.85 -44.61 46.95 Favored 'Trans proline' 0 C--N 1.357 1.001 0 C-N-CA 124.187 3.258 . . . . 0.0 115.408 171.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.21 -37.21 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 120.442 1.474 . . . . 0.0 112.896 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.79 -24.93 67.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.629 0.771 . . . . 0.0 110.975 175.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.505 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.4 t90 -83.14 -51.16 7.75 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.496 168.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.505 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.3 t90 -64.98 -33.55 76.31 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.673 1.579 . . . . 0.0 111.278 -168.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -57.17 -44.24 83.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.734 1.214 . . . . 0.0 112.352 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.732 0 C-N-CA 125.294 1.438 . . . . 0.0 111.909 -173.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.8 mt -58.13 -30.5 66.38 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.251 1.02 . . . . 0.0 112.515 175.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 91.2 m -80.29 -37.19 33.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.587 1.155 . . . . 0.0 112.104 174.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -74.15 -31.88 62.9 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.519 -1.363 . . . . 0.0 113.602 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.59 -51.84 75.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 120.068 1.304 . . . . 0.0 112.208 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.64 -33.19 36.48 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 CA-C-N 121.922 1.722 . . . . 0.0 113.5 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -62.99 -41.43 99.57 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.625 1.557 . . . . 0.0 113.008 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.44 -28.35 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.832 -0.542 . . . . 0.0 112.427 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 54.6 mt -67.23 -47.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.302 0.501 . . . . 0.0 110.318 172.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -57.99 -44.31 87.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.857 0.863 . . . . 0.0 111.624 172.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.73 -23.45 63.2 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.942 -1.099 . . . . 0.0 113.173 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.34 -51.12 8.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.626 1.103 . . . . 0.0 112.434 175.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -26.65 68.51 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 120.614 1.552 . . . . 0.0 113.508 173.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -73.02 -29.79 63.27 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.467 1.507 . . . . 0.0 114.663 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -131.63 64.87 74.45 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.51 -15.35 40.73 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.851 3.034 . . . . 0.0 116.483 -168.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -84.33 -12.84 53.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.561 1.144 . . . . 0.0 114.051 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -77.48 163.54 26.24 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.726 1.21 . . . . 0.0 112.529 -170.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -79.18 143.89 34.97 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.837 -0.54 . . . . 0.0 109.813 169.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.78 -39.51 85.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' B' ' 85' ' ' LYS . 3.0 m-30 -82.65 -26.7 31.92 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.9 t -61.58 -19.18 61.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.903 -1.123 . . . . 0.0 112.187 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.68 -4.19 1.9 Allowed 'General case' 0 CA--C 1.538 0.518 0 O-C-N 119.554 -1.966 . . . . 0.0 113.957 171.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -33.68 71.58 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.554 1.07 . . . . 0.0 111.965 166.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.01 -32.42 73.78 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -167.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -71.06 -28.2 64.19 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.744 2.018 . . . . 0.0 115.154 172.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -167.34 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.501 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.422 -1.852 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -128.94 57.58 1.62 Allowed 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 123.402 0.681 . . . . 0.0 109.947 169.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.501 ' H ' ' HG2' ' A' ' 3' ' ' GLU . . . -53.35 -40.64 65.08 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.166 1.348 . . . . 0.0 109.414 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' A' ' 67' ' ' TYR . 3.0 mppt? -45.39 -29.03 0.97 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 130.592 3.557 . . . . 0.0 114.893 169.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -134.77 21.99 3.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.963 1.705 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.4 ttm -60.05 120.02 8.91 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 177.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.3 t -74.97 152.1 38.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -173.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.35 -28.4 69.26 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.624 -1.297 . . . . 0.0 113.165 -170.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.41 90.94 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.886 0.766 . . . . 0.0 111.595 169.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -70.47 -37.14 74.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.257 1.023 . . . . 0.0 111.949 175.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -59.38 -52.29 66.27 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.349 -0.845 . . . . 0.0 112.812 174.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.2 pt -69.87 0.93 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 112.627 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -112.61 -14.76 13.14 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.072 1.749 . . . . 0.0 114.02 173.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.03 162.72 21.51 Favored 'General case' 0 CA--C 1.552 1.049 0 O-C-N 120.88 -1.137 . . . . 0.0 110.127 169.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.416 HD22 ' HD3' ' A' ' 19' ' ' LYS . 50.4 t-20 -68.22 129.93 92.68 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 120.823 -1.173 . . . . 0.0 112.409 -175.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -58.81 -12.31 14.45 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.269 3.312 . . . . 0.0 116.15 176.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.416 ' HD3' HD22 ' A' ' 17' ' ' ASN . 7.6 mttt -65.37 -63.06 1.19 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.334 1.854 . . . . 0.0 108.669 166.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.62 0.92 44.75 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 72.8 mtp -59.54 -38.5 81.22 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.818 -1.176 . . . . 0.0 112.116 169.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 21.8 m -66.64 -51.53 39.97 Favored Pre-proline 0 N--CA 1.48 1.045 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -49.5 -46.75 25.32 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.66 2.907 . . . . 0.0 116.132 169.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.09 -39.65 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 120.954 -1.091 . . . . 0.0 112.765 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.12 -27.33 68.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.558 0.743 . . . . 0.0 111.803 173.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 81.1 t90 -83.43 -52.21 6.72 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.727 171.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.434 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.4 t90 -66.05 -34.63 78.53 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 120.213 1.37 . . . . 0.0 111.517 -168.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -56.58 -42.83 79.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.988 1.315 . . . . 0.0 111.731 171.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.546 0.817 0 C-N-CA 125.679 1.592 . . . . 0.0 113.788 175.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 119.373 -0.346 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -61.11 -30.63 70.47 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.41 0.684 . . . . 0.0 112.234 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.1 m -73.78 -38.29 64.71 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.375 0.67 . . . . 0.0 111.39 173.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -82.07 -24.22 35.37 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.667 -175.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.2 mm -52.49 -48.66 89.28 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 120.504 1.502 . . . . 0.0 111.79 177.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.4 -37.59 22.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 CA-C-N 121.484 1.566 . . . . 0.0 113.342 172.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.05 -37.02 84.78 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.671 -1.268 . . . . 0.0 113.292 -175.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.14 -22.19 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.7 mt -81.09 -50.95 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.562 0.745 . . . . 0.0 110.116 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -59.54 -39.61 84.52 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.08 0.952 . . . . 0.0 112.008 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.75 -30.33 70.52 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 122.952 0.501 . . . . 0.0 111.373 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.68 -46.89 28.74 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 174.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -29.97 68.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 121.094 1.77 . . . . 0.0 114.145 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.88 -34.52 60.0 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -132.04 78.08 70.1 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.506 1.123 . . . . 0.0 111.932 171.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -54.58 -12.57 4.49 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.844 3.696 . . . . 0.0 117.462 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.32 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.229 1.412 . . . . 0.0 112.817 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -66.07 159.5 25.91 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 113.1 -171.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -84.13 138.84 32.81 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.636 -0.665 . . . . 0.0 109.389 169.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.22 -34.33 66.21 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 172.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -85.36 -29.66 24.28 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 115.558 1.688 . . . . 0.0 115.558 -173.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.7 t -64.28 -12.48 41.94 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.11 -0.994 . . . . 0.0 112.078 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -66.34 -3.69 6.46 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 119.662 -1.899 . . . . 0.0 113.737 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 -30.55 32.94 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.431 1.492 . . . . 0.0 111.955 167.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -66.68 -28.52 68.52 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.11 1.364 . . . . 0.0 112.074 -173.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.05 -30.01 55.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 114.79 173.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -166.63 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.968 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 11.6 t 103.98 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 129.552 3.141 . . . . 0.0 114.343 169.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -33.7 71.84 Favored 'General case' 0 CA--C 1.554 1.099 0 O-C-N 120.522 -1.361 . . . . 0.0 110.711 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -41.25 74.95 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.104 2.162 . . . . 0.0 113.454 173.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.77 8.16 39.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.066 1.347 . . . . 0.0 113.297 -174.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.0 ttm -62.59 123.08 17.43 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 109.904 172.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -77.78 155.34 31.2 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.041 -1.037 . . . . 0.0 110.494 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.84 -32.84 74.14 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.274 -1.516 . . . . 0.0 112.984 -174.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.85 -31.65 72.9 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.871 0.76 . . . . 0.0 112.871 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -80.18 -36.63 34.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.306 1.443 . . . . 0.0 111.357 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -61.45 -48.55 80.64 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.784 0.834 . . . . 0.0 112.611 175.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.45 -1.43 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 123.73 0.812 . . . . 0.0 113.163 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -110.56 -9.29 14.56 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.38 1.872 . . . . 0.0 114.076 172.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 155.72 40.08 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 119.875 1.216 . . . . 0.0 110.702 174.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -67.75 130.84 92.84 Favored Pre-proline 0 N--CA 1.479 0.982 0 O-C-N 121.292 -0.88 . . . . 0.0 110.624 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -46.58 -35.06 16.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.193 3.262 . . . . 0.0 114.117 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 59.3 mttt -60.39 -14.8 20.85 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -132.92 19.01 4.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.891 1.678 . . . . 0.0 112.609 166.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.1 ttm -70.0 -52.01 27.68 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.802 1.241 . . . . 0.0 110.88 169.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 2.7 m -45.76 -56.62 9.63 Favored Pre-proline 0 N--CA 1.489 1.519 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.88 -43.29 58.49 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.052 3.168 . . . . 0.0 115.389 175.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.39 -38.3 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.184 1.356 . . . . 0.0 112.724 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.04 -26.99 68.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.99 0.916 . . . . 0.0 111.042 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.507 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.7 t90 -84.01 -52.87 5.97 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.294 168.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.507 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.8 t90 -64.33 -31.18 72.28 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 120.048 1.295 . . . . 0.0 112.683 -166.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -61.61 -49.31 77.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.592 1.157 . . . . 0.0 111.406 172.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.548 0.866 0 C-N-CA 125.492 1.517 . . . . 0.0 111.802 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 . . . . . 0 N--CA 1.47 0.549 0 CA-C-O 119.458 -0.306 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.72 -23.13 65.94 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -82.96 -33.26 26.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 119.284 -0.388 . . . . 0.0 112.021 172.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.64 -27.38 29.16 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.01 -42.43 85.29 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 120.599 1.545 . . . . 0.0 113.495 176.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.39 -35.07 5.23 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 CA-C-N 122.438 1.906 . . . . 0.0 113.476 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -66.69 -32.12 73.23 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.261 -1.525 . . . . 0.0 113.42 -176.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.26 -29.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.721 -0.612 . . . . 0.0 112.122 172.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -71.26 -49.42 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.47 0.708 . . . . 0.0 110.151 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -57.56 -41.69 81.52 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.426 0.69 . . . . 0.0 111.995 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -67.94 -34.67 77.04 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 118.986 0.812 . . . . 0.0 112.295 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.14 -44.62 68.48 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.263 -0.898 . . . . 0.0 112.413 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -29.29 65.35 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.446 1.475 . . . . 0.0 114.865 179.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -76.38 -27.44 56.39 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 170.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -132.97 73.05 76.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.019 1.328 . . . . 0.0 111.636 172.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -59.22 -11.57 13.53 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.037 3.158 . . . . 0.0 116.279 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -81.37 -23.19 37.85 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.78 1.632 . . . . 0.0 113.916 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -65.33 157.54 28.87 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.831 1.252 . . . . 0.0 111.279 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -96.07 133.61 40.12 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 118.322 -0.847 . . . . 0.0 109.289 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.8 tp -50.62 -38.52 46.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -168.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.273 4.8 m-85 -82.33 -1.02 48.36 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -177.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 62.4 p -64.99 -32.15 73.73 Favored 'General case' 0 N--CA 1.483 1.214 0 O-C-N 120.582 -1.324 . . . . 0.0 110.925 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -69.73 -1.87 10.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.415 1.486 . . . . 0.0 113.649 -176.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -77.7 -38.7 46.82 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.84 1.656 . . . . 0.0 112.244 167.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -27.62 64.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -167.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -70.28 -29.2 65.9 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.018 1.727 . . . . 0.0 114.581 170.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -167.959 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.8 t -99.37 92.69 5.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.699 1.2 . . . . 0.0 113.073 -165.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.13 -31.28 67.03 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.524 -1.36 . . . . 0.0 111.359 176.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.433 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.2 ptpt -74.52 -10.2 59.32 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 177.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -121.03 14.78 11.52 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.049 1.339 . . . . 0.0 111.821 168.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.42 118.95 7.62 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.855 -1.153 . . . . 0.0 108.016 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -76.53 154.87 34.18 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.176 -0.953 . . . . 0.0 109.672 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.15 -32.64 74.07 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.455 -1.403 . . . . 0.0 113.197 -172.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -62.82 -33.77 75.91 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 170.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -77.12 -37.16 54.67 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.071 1.349 . . . . 0.0 111.361 175.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -60.0 -50.15 74.88 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 121.469 -0.769 . . . . 0.0 112.353 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.8 pt -69.41 -2.84 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 124.561 1.144 . . . . 0.0 112.981 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -106.02 -12.11 15.91 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.249 1.42 . . . . 0.0 113.738 172.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.59 165.87 23.85 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.119 0.968 . . . . 0.0 110.474 170.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -72.34 131.98 84.43 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.786 -1.196 . . . . 0.0 111.74 -176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.1 -30.67 41.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.229 3.286 . . . . 0.0 116.077 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.2 mttt -51.5 -59.28 4.43 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.456 1.902 . . . . 0.0 108.893 169.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 178.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 78.0 mtp -61.85 -35.38 78.1 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.065 1.302 . . . . 0.0 111.343 169.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 28.2 m -64.38 -54.15 40.36 Favored Pre-proline 0 N--CA 1.48 1.048 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -175.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -52.46 -39.04 75.11 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 123.493 2.796 . . . . 0.0 116.094 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.8 p -78.03 -34.56 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.61 1.095 . . . . 0.0 113.491 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -24.67 67.93 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.334 1.053 . . . . 0.0 110.62 172.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.516 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 68.7 t90 -85.74 -56.46 3.48 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 117.939 -1.029 . . . . 0.0 112.612 168.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.6 t90 -64.88 -28.99 69.92 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 120.655 1.571 . . . . 0.0 112.759 -166.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -61.42 -52.12 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.338 1.055 . . . . 0.0 111.357 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.548 0.903 0 C-N-CA 125.839 1.656 . . . . 0.0 111.955 -175.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 120.139 0.019 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.2 mt -65.11 -24.01 67.31 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.778 -0.576 . . . . 0.0 112.541 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.9 m -80.01 -33.4 39.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.922 1.289 . . . . 0.0 111.319 172.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.4 mm100 -82.64 -30.33 29.44 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.729 1.149 . . . . 0.0 113.249 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.7 -41.84 85.98 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 120.277 1.399 . . . . 0.0 113.423 175.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.1 -36.58 7.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 122.392 1.89 . . . . 0.0 113.429 169.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -66.17 -35.15 79.7 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.778 1.626 . . . . 0.0 113.817 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.03 -17.45 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 174.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -88.68 -52.09 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.255 1.022 . . . . 0.0 110.904 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.91 -42.17 71.88 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.082 0.953 . . . . 0.0 110.947 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.15 -30.7 70.76 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.049 -0.407 . . . . 0.0 111.403 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.9 m -74.68 -45.12 46.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.101 -0.952 . . . . 0.0 113.199 174.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.8 69.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 120.883 1.674 . . . . 0.0 114.166 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -82.2 -26.55 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -130.75 75.02 79.42 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 125.606 1.563 . . . . 0.0 110.912 170.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -60.75 -11.28 16.95 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.799 3.666 . . . . 0.0 115.871 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -80.28 -25.37 39.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.832 1.653 . . . . 0.0 112.782 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -69.96 160.51 31.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.43 1.492 . . . . 0.0 111.955 -172.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.62 146.92 26.64 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.561 -0.712 . . . . 0.0 110.058 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 57.1 tp -61.97 -31.63 72.0 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.263 -0.898 . . . . 0.0 113.219 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.433 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 2.4 m-85 -89.62 -24.87 21.56 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 -171.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -63.02 -15.43 56.43 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.863 -1.148 . . . . 0.0 112.071 171.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -66.26 -5.89 11.95 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.513 -1.992 . . . . 0.0 113.743 169.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -34.51 60.57 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.44 1.496 . . . . 0.0 111.606 167.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -62.96 -25.13 68.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.176 1.79 . . . . 0.0 112.774 -170.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -85.08 -30.89 23.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.423 1.889 . . . . 0.0 115.955 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 -166.245 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.258 50.1 mm-40 . . . . . 0 CA--C 1.545 0.782 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 101.42 93.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 131.14 3.776 . . . . 0.0 115.008 169.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.14 -34.17 69.97 Favored 'General case' 0 CA--C 1.555 1.136 0 O-C-N 120.383 -1.448 . . . . 0.0 110.641 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.418 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 15.5 mtmt -58.4 -34.75 71.09 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.3 1.84 . . . . 0.0 114.538 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -105.44 8.73 33.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.914 1.285 . . . . 0.0 112.976 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.9 ttm -62.38 123.79 19.2 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.635 1.107 . . . . 0.0 109.662 171.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -76.32 154.7 34.83 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 121.015 -1.053 . . . . 0.0 110.307 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.38 -31.95 73.24 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.162 -1.586 . . . . 0.0 113.187 -173.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -65.29 -32.49 74.17 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.155 0.889 . . . . 0.0 112.933 172.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -77.85 -37.35 48.58 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.303 1.441 . . . . 0.0 111.298 176.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -62.83 -47.69 82.33 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.547 -0.72 . . . . 0.0 112.75 176.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -69.76 -3.53 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -104.49 -10.61 17.54 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.043 1.737 . . . . 0.0 114.251 170.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.69 160.42 32.66 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 119.895 1.225 . . . . 0.0 110.895 173.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -65.72 129.96 94.43 Favored Pre-proline 0 N--CA 1.48 1.062 0 O-C-N 121.118 -0.989 . . . . 0.0 111.571 -178.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.43 -17.38 47.39 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.278 2.652 . . . . 0.0 114.783 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 mptt -54.69 -69.39 0.13 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.501 1.52 . . . . 0.0 109.889 168.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.87 -11.53 60.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -175.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -54.58 -35.5 63.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 120.618 -1.302 . . . . 0.0 112.532 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 32.4 m -61.87 -57.8 21.93 Favored Pre-proline 0 N--CA 1.483 1.208 0 CA-C-O 117.719 -1.134 . . . . 0.0 113.542 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -53.95 -37.1 85.68 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.97 3.114 . . . . 0.0 114.244 169.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.71 -50.14 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.562 -0.711 . . . . 0.0 111.534 174.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.11 -40.28 95.87 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.185 0.994 . . . . 0.0 109.897 -176.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.489 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 75.1 t90 -68.36 -49.65 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 116.991 -1.481 . . . . 0.0 112.592 172.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.85 -26.41 65.13 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 121.416 1.916 . . . . 0.0 111.268 -170.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -63.29 -48.83 76.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.385 1.074 . . . . 0.0 111.045 169.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.791 0 C-N-CA 124.865 1.266 . . . . 0.0 112.172 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -59.31 -30.43 68.33 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.767 0.827 . . . . 0.0 112.423 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 86.8 m -78.75 -36.89 42.45 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.426 1.09 . . . . 0.0 111.625 174.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -78.66 -32.65 47.28 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.947 -1.095 . . . . 0.0 113.741 -176.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.41 -45.24 95.26 Favored Pre-proline 0 N--CA 1.481 1.087 0 CA-C-N 120.364 1.438 . . . . 0.0 113.09 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.69 -34.99 8.31 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 122.228 1.831 . . . . 0.0 113.277 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -66.19 -32.78 74.42 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.329 -1.482 . . . . 0.0 113.983 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 23.0 m -71.59 -27.19 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 121.798 -0.564 . . . . 0.0 111.878 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -72.3 -47.29 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.463 0.705 . . . . 0.0 110.131 170.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -57.88 -41.06 81.73 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.697 0.799 . . . . 0.0 112.075 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.73 -32.35 74.0 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.279 0.945 . . . . 0.0 112.263 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.37 -47.4 56.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.876 -1.14 . . . . 0.0 112.428 176.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.85 -29.02 66.17 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 120.555 1.525 . . . . 0.0 114.804 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -74.41 -28.53 61.11 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 170.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -134.21 73.91 68.63 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.073 1.349 . . . . 0.0 111.71 173.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -59.93 -11.11 14.02 Favored 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 124.018 3.145 . . . . 0.0 116.033 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -81.0 -22.63 39.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.929 1.692 . . . . 0.0 114.175 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -63.89 155.47 30.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.237 1.415 . . . . 0.0 111.085 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -91.33 133.73 35.19 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.8 tp -51.07 -39.01 55.05 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -168.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.418 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.7 m-85 -81.43 -5.54 58.01 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -176.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 77.0 p -59.22 -27.44 65.75 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.378 -1.451 . . . . 0.0 111.163 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -72.48 -2.48 19.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.209 1.404 . . . . 0.0 113.666 177.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -80.31 -32.06 38.06 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.747 1.158 . . . . 0.0 111.748 167.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -64.34 -26.62 68.56 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.201 1.0 . . . . 0.0 112.738 -169.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -77.01 -27.76 54.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.385 2.274 . . . . 0.0 116.149 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -166.09 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.7 t 98.59 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 128.72 2.808 . . . . 0.0 117.361 164.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.9 -34.89 73.78 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 119.88 -1.763 . . . . 0.0 112.091 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -72.12 -4.42 28.93 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 175.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.65 5.15 11.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.501 1.52 . . . . 0.0 112.445 169.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.3 ttm -62.56 125.67 24.73 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.641 -1.287 . . . . 0.0 109.54 175.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.71 154.79 29.8 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.402 -0.811 . . . . 0.0 110.496 179.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.03 -34.11 75.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.413 -1.429 . . . . 0.0 113.083 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.49 -31.86 73.15 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.715 0.806 . . . . 0.0 112.871 172.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -78.44 -38.13 42.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.958 1.303 . . . . 0.0 111.697 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -58.81 -50.03 75.47 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.533 0.733 . . . . 0.0 112.452 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.0 pt -67.86 -7.18 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.43 1.092 . . . . 0.0 112.98 177.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.51 -7.95 17.28 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.85 1.66 . . . . 0.0 113.607 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.23 159.29 32.7 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 110.702 175.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -64.93 128.87 94.16 Favored Pre-proline 0 N--CA 1.483 1.184 0 O-C-N 121.222 -0.924 . . . . 0.0 112.088 -173.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -56.91 -16.58 20.82 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.838 3.026 . . . . 0.0 115.247 178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -61.71 -69.71 0.23 Allowed 'General case' 0 C--N 1.348 0.524 0 C-N-CA 125.819 1.648 . . . . 0.0 110.15 167.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.28 -3.12 48.09 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.5 ttt -58.91 -36.65 75.07 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 169.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -65.43 -51.5 51.55 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.437 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 5.8 Cg_endo -51.55 -47.71 24.87 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.048 2.499 . . . . 0.0 114.904 169.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 p -67.36 -37.53 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.788 -1.195 . . . . 0.0 113.162 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.46 -17.34 63.74 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.158 0.983 . . . . 0.0 112.854 175.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.467 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.7 t90 -97.97 -45.24 6.35 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.922 1.237 . . . . 0.0 111.814 168.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 31.5 t-105 -59.33 -34.29 72.16 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.108 0.963 . . . . 0.0 111.456 -172.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -74.13 -51.6 15.13 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.453 169.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 tm? . . . . . 0 CA--C 1.534 0.364 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -168.116 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 . . . . . 0 CA--C 1.536 0.413 0 CA-C-O 119.631 -0.223 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.52 -27.42 69.14 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.806 -1.184 . . . . 0.0 112.185 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 90.8 m -76.06 -36.79 58.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.569 0.747 . . . . 0.0 111.45 170.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -84.56 -27.6 27.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -176.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.25 -42.17 85.2 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 120.235 1.38 . . . . 0.0 112.918 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.47 -37.46 5.56 Favored 'Trans proline' 0 C--N 1.352 0.756 0 CA-C-N 122.145 1.802 . . . . 0.0 113.02 169.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -67.84 -33.09 74.09 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.226 -1.546 . . . . 0.0 113.76 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.6 m -68.21 -17.27 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.908 0.776 . . . . 0.0 113.083 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -87.43 -52.1 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.72 1.208 . . . . 0.0 110.186 172.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -56.67 -40.33 75.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.423 1.089 . . . . 0.0 111.838 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -71.96 -24.88 61.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.552 -0.717 . . . . 0.0 111.12 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.95 -43.69 21.63 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.318 -0.864 . . . . 0.0 112.193 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -27.78 69.53 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 120.444 1.475 . . . . 0.0 113.586 172.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -71.59 -37.7 70.96 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 169.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -125.22 63.53 42.64 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.001 1.32 . . . . 0.0 111.353 -176.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.17 -13.48 16.07 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.189 3.259 . . . . 0.0 115.905 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -86.1 -21.12 27.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.765 1.626 . . . . 0.0 113.581 -178.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -70.26 160.18 32.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.933 0.893 . . . . 0.0 112.008 -172.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.58 132.05 39.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -50.03 -36.61 29.53 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.5 m-85 -80.52 -9.33 59.77 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.795 -1.19 . . . . 0.0 114.06 -176.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -60.68 -26.83 67.39 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.646 -1.284 . . . . 0.0 111.348 168.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -71.88 -2.47 18.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.348 1.459 . . . . 0.0 114.274 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 -31.77 24.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.815 1.189 . . . . 0.0 111.678 168.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.78 -28.11 63.4 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.889 1.276 . . . . 0.0 111.87 -171.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -69.98 -30.19 67.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.75 1.22 . . . . 0.0 114.008 171.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -167.954 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.471 0.623 0 CA-C-O 117.829 -1.081 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 61.1 m 107.51 84.06 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 129.857 3.263 . . . . 0.0 115.761 167.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.29 69.16 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.243 -1.536 . . . . 0.0 111.751 175.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.464 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 8.3 ptpt -77.7 3.03 15.02 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 175.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -125.9 7.97 7.42 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.942 1.297 . . . . 0.0 112.194 169.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 34.5 ttm -62.71 125.04 22.6 Favored 'General case' 0 C--N 1.346 0.457 0 O-C-N 121.048 -1.032 . . . . 0.0 109.597 176.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.4 t -77.63 153.15 33.44 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.81 -0.556 . . . . 0.0 110.1 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.05 -30.62 71.68 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 120.475 -1.391 . . . . 0.0 112.978 -173.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -64.67 -31.67 73.0 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.857 0.753 . . . . 0.0 112.847 170.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -78.53 -38.39 40.65 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.854 1.261 . . . . 0.0 111.414 174.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -59.7 -48.15 82.83 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 121.541 -0.724 . . . . 0.0 112.728 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.57 -2.28 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.961 0.904 . . . . 0.0 113.116 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -109.31 -12.68 14.73 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.282 1.833 . . . . 0.0 114.112 173.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 157.78 35.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.944 1.247 . . . . 0.0 111.032 172.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -66.59 130.21 94.1 Favored Pre-proline 0 N--CA 1.483 1.178 0 O-C-N 121.462 -0.774 . . . . 0.0 111.614 -175.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.82 -18.3 33.75 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.562 2.841 . . . . 0.0 115.188 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -58.5 -68.69 0.23 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.07 1.748 . . . . 0.0 109.512 167.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.31 -2.49 49.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -177.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.9 ttm -61.92 -36.99 82.98 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 120.71 -1.243 . . . . 0.0 111.811 168.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 49.8 m -63.88 -52.26 58.38 Favored Pre-proline 0 N--CA 1.483 1.202 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.827 -177.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . 0.416 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 3.1 Cg_exo -47.8 -49.56 13.4 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 124.303 3.335 . . . . 0.0 114.932 169.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.91 -33.9 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 119.201 0.909 . . . . 0.0 113.205 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -25.13 67.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.807 0.843 . . . . 0.0 112.007 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 70.2 t90 -83.55 -55.85 4.06 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.078 165.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.4 t90 -62.62 -34.45 77.05 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 117.534 -1.666 . . . . 0.0 114.108 -162.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -64.74 -43.29 93.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.15 0.98 . . . . 0.0 111.601 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.545 0.755 0 C-N-CA 126.209 1.804 . . . . 0.0 111.739 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -57.48 -29.49 64.31 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.615 0.766 . . . . 0.0 112.476 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.9 m -81.21 -36.1 30.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.475 1.11 . . . . 0.0 112.161 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.48 -29.39 28.03 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.88 -41.34 78.48 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 120.163 1.347 . . . . 0.0 113.365 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -74.15 -36.43 3.33 Favored 'Trans proline' 0 C--N 1.354 0.86 0 CA-C-N 122.257 1.842 . . . . 0.0 113.613 169.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -66.81 -30.44 70.63 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.398 -1.439 . . . . 0.0 114.092 -175.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.4 m -69.09 -22.19 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 28.3 mt -79.2 -50.98 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.258 1.023 . . . . 0.0 109.581 170.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -59.05 -38.55 79.64 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.11 -29.98 68.17 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.002 0.819 . . . . 0.0 112.227 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.88 -47.58 44.77 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.168 -0.957 . . . . 0.0 112.505 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -28.27 67.49 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 120.333 1.424 . . . . 0.0 114.472 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -77.29 -24.68 50.93 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.051 1.501 . . . . 0.0 115.051 171.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -135.08 72.79 66.69 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.807 1.243 . . . . 0.0 111.892 172.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.76 -12.16 17.16 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.804 3.003 . . . . 0.0 117.182 -173.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.71 -20.6 39.08 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.6 1.16 . . . . 0.0 113.486 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 52.0 mmtt -65.8 157.55 30.06 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.845 0.858 . . . . 0.0 112.135 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 28.2 t30 -93.07 131.47 38.06 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.2 tp -47.66 -39.02 16.15 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.385 1.474 . . . . 0.0 114.685 -172.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.464 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.4 m-85 -79.72 -8.79 59.45 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 68.4 p -60.46 -26.7 66.97 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 120.596 -1.315 . . . . 0.0 110.976 167.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -73.41 -2.22 21.47 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.18 1.392 . . . . 0.0 113.53 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -81.72 -32.87 31.39 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.688 1.131 . . . . 0.0 111.783 167.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -67.27 -31.12 71.22 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.539 1.136 . . . . 0.0 112.269 -169.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -70.38 -28.05 64.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.592 1.957 . . . . 0.0 115.502 172.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 115.596 1.702 . . . . 0.0 115.596 -166.434 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 N--CA 1.445 -0.699 0 N-CA-C 102.929 -2.989 . . . . 0.0 102.929 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.6 m -94.77 89.58 5.75 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 124.562 1.145 . . . . 0.0 112.345 -163.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.17 65.34 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 120.008 1.277 . . . . 0.0 111.014 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.42 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.2 mtmt -62.96 -20.72 65.52 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 127.16 2.184 . . . . 0.0 115.018 175.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -121.67 16.2 11.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.774 1.63 . . . . 0.0 111.778 177.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.3 ttm -61.77 117.73 6.23 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.53 155.04 36.48 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.162 -0.961 . . . . 0.0 109.499 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.18 -32.81 74.3 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.303 -1.498 . . . . 0.0 112.787 -172.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -62.84 -35.2 79.16 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 170.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -75.41 -37.88 60.21 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.826 1.251 . . . . 0.0 111.479 174.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -60.18 -50.69 72.67 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.531 -0.731 . . . . 0.0 112.241 177.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.5 pt -69.52 -1.19 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.547 1.139 . . . . 0.0 112.958 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -110.85 -10.87 14.41 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.728 1.611 . . . . 0.0 113.972 173.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 164.92 22.4 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.962 -1.086 . . . . 0.0 110.255 169.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.77 128.04 93.19 Favored Pre-proline 0 CA--C 1.556 1.196 0 O-C-N 120.84 -1.162 . . . . 0.0 112.219 -176.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -61.3 -7.26 8.06 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.788 3.658 . . . . 0.0 116.24 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 5.9 mptt -71.56 -59.29 2.83 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 127.072 2.149 . . . . 0.0 109.056 165.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.13 0.22 54.09 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 82.1 mtp -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 120.84 -1.162 . . . . 0.0 112.364 169.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.7 m -65.63 -51.18 51.82 Favored Pre-proline 0 N--CA 1.483 1.189 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.05 -45.62 39.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.179 2.586 . . . . 0.0 114.932 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.7 p -71.64 -31.88 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.605 -1.31 . . . . 0.0 113.419 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.1 -24.16 67.59 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.742 0.817 . . . . 0.0 111.485 171.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.439 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 74.0 t90 -85.09 -53.43 5.28 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.263 167.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -52.94 -34.48 55.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.075 0.94 . . . . 0.0 112.62 -172.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -69.62 -49.14 56.69 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.676 1.19 . . . . 0.0 112.259 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 125.79 1.636 . . . . 0.0 111.813 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.29 -24.99 67.85 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.08 0.952 . . . . 0.0 112.211 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.8 m -79.83 -32.19 40.6 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.46 1.104 . . . . 0.0 111.627 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -87.4 -28.7 21.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.577 1.08 . . . . 0.0 113.579 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.39 -41.97 79.27 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.185 173.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.41 -36.51 6.78 Favored 'Trans proline' 0 C--N 1.355 0.91 0 CA-C-N 122.382 1.886 . . . . 0.0 113.357 169.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -65.96 -35.62 81.08 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 120.317 -1.489 . . . . 0.0 113.565 -177.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.23 -21.43 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 174.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.6 mt -82.72 -51.37 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.901 0.88 . . . . 0.0 110.555 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.97 -43.21 73.3 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.043 0.937 . . . . 0.0 111.33 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -67.46 -30.05 69.67 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.918 -0.489 . . . . 0.0 111.732 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.5 m -74.41 -46.03 42.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.182 -0.913 . . . . 0.0 113.174 173.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -30.34 68.49 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.866 1.667 . . . . 0.0 114.453 177.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.252 20.4 pttt -79.21 -24.73 42.91 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 175.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -135.29 74.95 60.22 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 125.323 1.449 . . . . 0.0 112.522 169.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -59.53 -11.3 13.57 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.523 3.482 . . . . 0.0 117.176 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -80.15 -21.99 42.52 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.063 1.345 . . . . 0.0 113.369 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -69.43 159.22 33.63 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.861 1.264 . . . . 0.0 111.64 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.38 148.16 30.73 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.625 -0.672 . . . . 0.0 109.991 170.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.35 -33.55 75.76 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.27 -0.894 . . . . 0.0 112.666 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.42 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.7 m-85 -89.96 -24.66 21.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 117.007 2.225 . . . . 0.0 117.007 -169.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.8 t -60.0 -21.99 61.99 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.057 -1.027 . . . . 0.0 111.902 171.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -60.52 -7.44 2.14 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.944 -1.723 . . . . 0.0 113.709 171.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.7 tptt -66.9 -37.51 84.51 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.522 1.529 . . . . 0.0 112.258 167.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -29.88 71.03 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -167.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -85.29 -23.16 28.26 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.581 1.952 . . . . 0.0 115.848 -175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 118.501 2.778 . . . . 0.0 118.501 -163.099 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.43 ' HB3' ' HE3' ' A' ' 19' ' ' LYS 0.25 52.9 mm-40 . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 72.7 m 108.0 84.47 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 130.595 3.558 . . . . 0.0 112.334 171.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.84 67.94 Favored 'General case' 0 CA--C 1.556 1.205 0 O-C-N 120.843 -1.161 . . . . 0.0 111.219 173.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.43 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 11.9 mtmt -63.42 -16.72 61.38 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 127.232 2.213 . . . . 0.0 116.601 173.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -121.2 9.32 10.43 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.866 1.266 . . . . 0.0 112.603 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.4 ttm -60.93 124.1 19.5 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.391 -0.818 . . . . 0.0 109.42 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -77.46 156.04 31.34 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.634 -0.667 . . . . 0.0 110.907 -177.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.41 -32.83 74.61 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.133 -1.604 . . . . 0.0 113.112 -173.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.78 -29.03 69.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.032 0.833 . . . . 0.0 112.611 171.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -84.25 -36.33 22.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.756 1.622 . . . . 0.0 111.313 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -62.26 -48.95 77.66 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.381 -0.824 . . . . 0.0 112.789 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.69 -6.3 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.816 0.847 . . . . 0.0 112.874 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.91 -11.57 15.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.314 1.846 . . . . 0.0 114.535 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.88 158.4 35.61 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.906 1.23 . . . . 0.0 110.845 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -66.38 131.03 94.22 Favored Pre-proline 0 N--CA 1.481 1.085 0 O-C-N 121.335 -0.853 . . . . 0.0 111.622 -176.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -60.9 -18.68 58.46 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.125 2.55 . . . . 0.0 114.566 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -55.34 -67.82 0.25 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.183 1.393 . . . . 0.0 109.85 168.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.02 -4.58 57.07 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 31.4 ttm -59.88 -41.04 90.69 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.04 -1.038 . . . . 0.0 112.032 168.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 67.5 m -56.04 -54.9 47.32 Favored Pre-proline 0 N--CA 1.484 1.229 0 CA-C-O 117.97 -1.014 . . . . 0.0 113.45 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.74 -53.82 5.04 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.02 3.147 . . . . 0.0 113.699 171.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.6 -31.91 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 119.448 -2.032 . . . . 0.0 113.306 -176.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.96 73.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.186 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' TRP . . . . . . . . . . . . 0.288 0.0 OUTLIER -86.37 -39.23 16.63 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 116.487 -1.72 . . . . 0.0 112.322 176.261 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' TRP . . . . . 0.439 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.4 m0 -62.26 -22.13 65.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 122.419 2.372 . . . . 0.0 113.022 173.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -77.47 -57.84 3.6 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.981 0.912 . . . . 0.0 111.873 168.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 CA--C 1.546 0.81 0 C-N-CA 123.671 0.788 . . . . 0.0 112.271 -172.599 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 . . . . . 0 N--CA 1.467 0.389 0 N-CA-C 110.572 -0.159 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 91.6 mt -57.14 -28.21 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.028 0.931 . . . . 0.0 112.389 173.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.5 m -80.8 -36.11 32.17 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.921 0.888 . . . . 0.0 112.013 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -81.95 -31.4 31.26 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.758 1.163 . . . . 0.0 114.058 -177.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.02 -39.68 72.62 Favored Pre-proline 0 CA--C 1.552 1.039 0 CA-C-N 120.07 1.305 . . . . 0.0 113.163 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -75.15 -36.37 2.51 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 122.388 1.889 . . . . 0.0 113.366 169.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -66.06 -29.74 70.14 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.395 -1.441 . . . . 0.0 113.908 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 32.3 m -69.38 -21.75 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 122.968 0.507 . . . . 0.0 112.327 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 10.3 mt -77.68 -50.7 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.327 1.051 . . . . 0.0 109.697 169.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.42 -39.57 87.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.293 0.637 . . . . 0.0 112.516 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.46 -27.46 65.24 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.019 0.827 . . . . 0.0 112.209 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.11 -50.11 20.93 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.453 -0.779 . . . . 0.0 112.319 175.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -27.32 68.4 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -79.05 -20.18 49.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 171.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -136.44 66.71 58.93 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.472 1.509 . . . . 0.0 110.52 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.23 -14.26 37.17 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 124.142 3.228 . . . . 0.0 116.494 -168.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.95 -24.72 48.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -62.62 157.96 19.42 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.937 1.295 . . . . 0.0 112.302 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -82.17 150.65 27.29 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.552 -0.717 . . . . 0.0 109.988 171.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.72 -41.18 99.04 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.293 -0.879 . . . . 0.0 113.15 176.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 146' ' ' TYR . . . . . 0.43 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.7 m-85 -82.41 -19.72 38.5 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -169.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 11.6 t -64.04 -15.01 58.5 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.793 -1.192 . . . . 0.0 112.197 169.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -67.87 -2.56 7.56 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 119.313 -2.117 . . . . 0.0 113.532 169.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -77.71 -30.81 51.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.69 1.132 . . . . 0.0 111.92 165.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -63.52 -33.38 75.45 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.919 1.288 . . . . 0.0 112.177 -169.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.94 -29.06 64.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.618 1.967 . . . . 0.0 115.346 170.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 125.408 1.483 . . . . 0.0 113.025 -168.412 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.25 51.7 t30 57.83 46.13 17.42 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.091 1.756 . . . . 0.0 114.918 176.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -62.74 -20.75 65.24 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.973 167.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.2 t 97.07 93.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 128.885 2.874 . . . . 0.0 117.422 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.53 -33.64 70.09 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 119.921 -1.737 . . . . 0.0 112.345 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.472 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 1.1 ptpt -73.85 -9.87 59.08 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 176.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -113.9 5.06 16.07 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.92 1.288 . . . . 0.0 112.468 168.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 29.0 ttm -60.57 127.31 31.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.957 1.253 . . . . 0.0 109.482 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -78.99 155.89 28.68 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.33 -35.75 78.26 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 120.338 -1.476 . . . . 0.0 112.801 -175.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -61.69 -32.47 72.67 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.668 0.787 . . . . 0.0 113.014 172.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -80.57 -36.84 32.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.115 1.366 . . . . 0.0 111.56 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.11 -48.57 81.13 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.532 -0.73 . . . . 0.0 112.327 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.2 pt -70.41 -2.04 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 124.318 1.047 . . . . 0.0 112.809 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -113.46 -15.08 12.66 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.973 1.709 . . . . 0.0 114.281 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 161.81 20.5 Favored 'General case' 0 CA--C 1.558 1.251 0 O-C-N 120.981 -1.074 . . . . 0.0 110.498 169.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -63.92 132.53 95.28 Favored Pre-proline 0 N--CA 1.483 1.189 0 O-C-N 120.894 -1.129 . . . . 0.0 112.011 -176.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -62.22 -16.94 54.15 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.332 2.688 . . . . 0.0 114.831 -178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mptt -57.87 -62.81 1.54 Allowed 'General case' 0 C--N 1.351 0.657 0 C-N-CA 125.218 1.407 . . . . 0.0 108.829 167.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.56 -10.48 59.52 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 89.0 mtp -60.21 -37.68 81.02 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 120.905 -1.122 . . . . 0.0 112.937 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.4 m -61.22 -52.09 73.68 Favored Pre-proline 0 N--CA 1.485 1.295 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -59.7 -41.79 52.34 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.772 2.315 . . . . 0.0 113.285 169.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 87.9 t -56.73 -42.18 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 120.904 -1.123 . . . . 0.0 111.725 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.17 82.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.821 0.848 . . . . 0.0 111.556 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.14 -36.69 58.68 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.882 1.219 . . . . 0.0 111.351 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.495 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -52.13 -41.95 62.95 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.976 1.262 . . . . 0.0 112.254 176.111 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -72.98 -53.31 11.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.795 1.638 . . . . 0.0 111.805 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -66.88 -30.36 70.5 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.49 0.716 . . . . 0.0 112.237 -169.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -103.91 9.07 36.9 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.473 172.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 40.39 57.26 2.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 128.064 2.546 . . . . 0.0 114.799 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 52.58 17.91 0.89 Allowed 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 174.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.9 t -55.75 153.82 7.74 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -170.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.18 -9.0 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.124 1.37 . . . . 0.0 113.528 170.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 71.6 120.34 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.318 2.247 . . . . 0.0 114.687 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -118.52 157.67 26.85 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.639 1.576 . . . . 0.0 112.266 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.62 -11.89 12.37 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 125.106 1.336 . . . . 0.0 115.291 -177.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 169.18 -161.46 35.06 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.738 2.113 . . . . 0.0 111.064 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -125.65 20.51 7.85 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.127 1.371 . . . . 0.0 113.911 178.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 m -75.95 58.4 1.16 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.502 1.921 . . . . 0.0 111.175 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.5 m -67.0 2.06 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 126.679 1.992 . . . . 0.0 114.452 -177.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.64 151.19 11.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.26 1.824 . . . . 0.0 112.21 172.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.9 mt -63.98 121.28 13.73 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.823 -0.548 . . . . 0.0 110.985 170.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -86.37 162.43 18.18 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.799 1.64 . . . . 0.0 109.943 174.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.81 -29.32 69.22 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.138 -1.601 . . . . 0.0 112.939 -175.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.0 m -60.26 -47.8 84.46 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.64 -49.24 78.3 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.499 0.719 . . . . 0.0 109.549 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.23 -34.6 72.4 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.563 1.145 . . . . 0.0 111.904 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 98.4 m -71.98 -36.2 69.74 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.762 0.825 . . . . 0.0 111.189 174.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -79.49 -24.86 42.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.519 -178.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.77 -46.1 98.53 Favored Pre-proline 0 N--CA 1.481 1.092 0 CA-C-N 120.824 1.647 . . . . 0.0 112.535 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.25 -37.6 10.16 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.808 1.672 . . . . 0.0 113.3 170.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -66.08 -34.9 79.12 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.704 -1.247 . . . . 0.0 113.391 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.6 m -68.96 -17.17 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 118.965 0.802 . . . . 0.0 113.16 175.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -88.42 -52.44 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.369 1.068 . . . . 0.0 110.367 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -55.7 -47.82 76.17 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.292 1.037 . . . . 0.0 110.621 177.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -63.54 -25.24 68.16 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.43 -0.794 . . . . 0.0 112.106 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.17 -49.03 13.21 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.484 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.01 68.62 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 120.961 1.71 . . . . 0.0 113.966 174.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -71.22 -28.32 64.11 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 114.392 169.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.4 m-80 -135.37 66.57 65.89 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.982 1.313 . . . . 0.0 112.383 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -57.59 -15.68 21.28 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.591 2.861 . . . . 0.0 116.575 -173.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -82.6 -21.3 35.22 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.298 1.439 . . . . 0.0 113.523 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -71.62 160.37 32.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.694 1.197 . . . . 0.0 111.933 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -76.56 154.7 34.26 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.854 -0.529 . . . . 0.0 109.891 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -70.18 -38.42 75.37 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.264 -0.898 . . . . 0.0 113.103 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.472 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 1.4 m-85 -82.58 -21.96 35.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.0 t -60.11 -20.76 59.86 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.377 -0.827 . . . . 0.0 111.961 173.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -62.03 -5.07 1.93 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.586 -1.946 . . . . 0.0 114.074 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -33.77 74.13 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 119.806 1.184 . . . . 0.0 111.518 165.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -62.13 -31.93 72.46 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -167.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -74.78 -28.01 60.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.774 1.63 . . . . 0.0 115.129 176.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -94.23 128.78 40.89 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -166.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.8 m -90.2 -24.83 20.9 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 52.56 -96.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.611 1.564 . . . . 0.0 114.024 -173.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -168.75 -31.71 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.257 2.223 . . . . 0.0 112.101 -169.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.19 149.76 86.06 Favored Pre-proline 0 CA--C 1.56 1.344 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 -175.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -87.17 153.89 8.2 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.073 3.182 . . . . 0.0 113.554 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 116.999 -1.477 . . . . 0.0 112.735 168.774 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.436 0.16 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.25 13.8 t-20 68.02 66.65 0.35 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 124.612 2.149 . . . . 0.0 112.527 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -117.47 154.09 32.0 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 129.807 3.243 . . . . 0.0 103.69 167.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m -87.57 87.91 7.52 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 125.298 1.439 . . . . 0.0 113.285 -165.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.88 -38.57 56.59 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 120.383 1.447 . . . . 0.0 110.463 170.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -67.8 -7.03 24.28 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 127.686 2.394 . . . . 0.0 115.707 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -136.59 18.85 3.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.91 1.284 . . . . 0.0 112.482 174.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.9 ttm -59.48 120.92 10.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 168.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.0 t -73.77 153.79 39.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.107 -0.995 . . . . 0.0 109.552 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.71 -31.24 72.11 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.55 -1.344 . . . . 0.0 113.235 -172.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -65.84 -32.43 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.198 0.908 . . . . 0.0 113.121 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -76.5 -36.6 57.69 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.292 1.437 . . . . 0.0 111.115 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -63.79 -48.64 76.07 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.29 -0.881 . . . . 0.0 112.932 177.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.0 pt -69.63 -5.16 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 123.345 0.658 . . . . 0.0 112.697 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -103.47 -15.46 15.87 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.221 1.808 . . . . 0.0 114.23 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 158.86 31.72 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.9 1.227 . . . . 0.0 110.581 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -66.4 132.05 94.29 Favored Pre-proline 0 N--CA 1.481 1.092 0 O-C-N 121.416 -0.802 . . . . 0.0 111.6 -174.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -56.95 -20.46 36.69 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.81 3.007 . . . . 0.0 115.379 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -56.7 -64.12 0.98 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.996 1.719 . . . . 0.0 108.89 166.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.34 -12.15 59.1 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.0 ttm -57.02 -35.87 69.77 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.511 -1.368 . . . . 0.0 111.916 172.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.4 m -63.0 -54.92 42.25 Favored Pre-proline 0 N--CA 1.482 1.155 0 C-N-CA 124.319 1.047 . . . . 0.0 112.81 -177.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -50.1 -45.94 30.74 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.5 2.8 . . . . 0.0 113.685 168.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.64 -38.51 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.003 0.82 . . . . 0.0 111.838 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.63 90.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.576 0.751 . . . . 0.0 111.297 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CG ' ' CH2' ' A' ' 27' ' ' TRP . 89.5 t90 -67.35 -46.79 72.35 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.59 1.086 . . . . 0.0 110.243 167.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -58.34 -33.28 69.36 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 123.427 1.584 . . . . 0.0 113.073 -168.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.3 tmm? -76.05 -42.59 47.11 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.234 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.91 -22.82 67.06 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.849 -1.157 . . . . 0.0 114.063 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 -141.56 95.87 2.89 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.927 2.091 . . . . 0.0 109.267 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.25 169.34 1.65 Allowed 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 -174.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.1 2.14 0.38 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 174.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.3 t -62.91 177.72 0.54 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.728 1.211 . . . . 0.0 112.474 169.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -109.58 153.53 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.498 1.519 . . . . 0.0 110.506 -178.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.33 168.49 18.96 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -169.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 26.8 mtmt -121.26 54.46 1.11 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.47 1.508 . . . . 0.0 113.538 -167.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.06 31.33 26.2 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.431 1.015 . . . . 0.0 115.063 169.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -156.76 -171.26 22.7 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.121 0.867 . . . . 0.0 114.473 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -126.55 10.92 7.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.964 1.306 . . . . 0.0 114.52 -173.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 33.5 p -72.69 13.8 0.33 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.93 -15.94 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.552 1.541 . . . . 0.0 113.494 171.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.43 161.75 1.82 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.791 1.236 . . . . 0.0 112.848 169.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 75.5 mt -74.38 71.31 1.76 Allowed 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 122.321 1.058 . . . . 0.0 108.616 166.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -64.71 166.85 8.18 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.342 2.257 . . . . 0.0 110.998 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.91 -26.28 65.91 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.486 -1.384 . . . . 0.0 113.998 -170.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.0 m -66.94 -47.89 70.25 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.313 -0.867 . . . . 0.0 110.476 169.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.84 -47.23 86.58 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.486 -0.759 . . . . 0.0 111.943 174.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.57 -30.06 64.94 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.183 -0.948 . . . . 0.0 112.706 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 68.0 m -80.39 -34.47 36.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.952 0.901 . . . . 0.0 111.949 174.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -79.63 -36.84 37.28 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 117.869 -1.062 . . . . 0.0 113.527 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -48.96 -46.3 74.68 Favored Pre-proline 0 N--CA 1.478 0.929 0 CA-C-N 120.238 1.381 . . . . 0.0 113.017 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.6 -38.21 6.24 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 CA-C-N 122.074 1.777 . . . . 0.0 113.448 171.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -64.81 -34.4 78.27 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.913 1.233 . . . . 0.0 113.367 -175.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 20.8 m -75.48 -27.86 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.217 0.607 . . . . 0.0 112.575 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.9 mt -67.8 -47.24 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.09 -38.82 80.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.887 0.875 . . . . 0.0 112.316 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.49 -31.88 73.19 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.181 0.901 . . . . 0.0 112.149 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -72.14 -48.01 46.77 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.802 -1.186 . . . . 0.0 112.397 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -29.4 68.54 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.181 1.355 . . . . 0.0 114.502 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -79.32 -22.08 45.04 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 171.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.47 64.89 66.12 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 126.66 1.984 . . . . 0.0 110.45 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -64.22 -11.49 28.11 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.988 3.125 . . . . 0.0 115.881 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -81.42 -21.26 39.02 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.705 1.202 . . . . 0.0 113.387 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -68.03 159.03 31.6 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.838 0.855 . . . . 0.0 112.373 -173.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -83.9 127.91 34.18 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.7 tp -44.73 -38.86 4.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.03 -7.59 58.23 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 57.4 p -60.43 -30.15 69.45 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 120.579 -1.325 . . . . 0.0 111.125 167.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -69.54 -2.45 11.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.774 1.63 . . . . 0.0 113.533 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -38.38 53.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.159 0.983 . . . . 0.0 110.896 166.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -29.97 71.02 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -167.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -68.68 -27.78 66.28 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.661 1.984 . . . . 0.0 115.646 170.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -104.46 105.38 15.47 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.11 1.364 . . . . 0.0 114.214 -167.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 19.7 m -84.97 30.77 0.57 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.007 1.323 . . . . 0.0 114.253 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -83.55 -17.89 40.23 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -169.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -84.88 44.44 1.07 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -170.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -155.9 158.78 31.81 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.725 1.61 . . . . 0.0 111.596 172.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -65.78 155.0 71.46 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.715 2.277 . . . . 0.0 112.667 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.665 1.586 . . . . 0.0 112.85 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.312 10.4 t-20 68.31 35.34 3.48 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -73.89 161.32 30.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 126.87 2.068 . . . . 0.0 106.847 163.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.0 t -102.75 92.93 4.82 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.895 1.278 . . . . 0.0 113.065 -165.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.58 68.45 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.418 -1.426 . . . . 0.0 111.329 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 5.6 ptpt -74.41 -7.22 52.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.241 1.816 . . . . 0.0 115.228 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -123.41 15.81 9.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.404 1.482 . . . . 0.0 111.95 168.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.1 ttm -61.86 118.63 7.46 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.829 -1.169 . . . . 0.0 108.446 171.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -76.64 155.35 33.51 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.059 -1.026 . . . . 0.0 109.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.84 -29.72 69.71 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 120.312 -1.492 . . . . 0.0 113.784 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -40.74 96.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.114 0.87 . . . . 0.0 111.804 169.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -66.86 -37.02 83.65 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.772 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -60.91 -52.99 62.68 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.39 -0.819 . . . . 0.0 112.299 177.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.04 -0.93 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.103 1.361 . . . . 0.0 112.785 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -107.16 -15.59 14.63 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.427 1.491 . . . . 0.0 113.61 172.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.38 164.56 22.67 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.076 -1.015 . . . . 0.0 110.522 169.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -71.73 131.37 86.05 Favored Pre-proline 0 N--CA 1.484 1.233 0 O-C-N 120.867 -1.145 . . . . 0.0 112.411 -176.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -18.37 23.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.557 3.505 . . . . 0.0 116.299 175.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -60.36 -58.19 9.55 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.304 1.842 . . . . 0.0 109.212 167.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.46 -2.68 58.78 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 75.4 mtp -63.18 -36.65 84.33 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.43 -1.419 . . . . 0.0 111.509 169.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.7 m -59.81 -52.25 75.08 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 124.776 1.231 . . . . 0.0 113.362 -177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.402 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 8.3 Cg_endo -53.19 -58.58 1.38 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.165 2.576 . . . . 0.0 113.94 167.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.4 p -63.48 -25.26 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 120.893 1.679 . . . . 0.0 113.294 -169.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.37 67.94 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 118.124 -0.941 . . . . 0.0 113.21 171.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 62.6 t90 -84.03 -55.34 4.27 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.176 1.353 . . . . 0.0 114.303 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.453 ' CD1' ' N ' ' A' ' 27' ' ' TRP . 4.7 m95 -51.68 -40.28 59.79 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.886 0.85 . . . . 0.0 110.888 -173.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -58.57 -49.38 77.65 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.941 1.697 . . . . 0.0 111.934 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.77 -19.81 64.37 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.976 1.311 . . . . 0.0 113.755 175.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -101.81 -1.4 32.37 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 173.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 65.57 163.57 0.16 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.193 2.197 . . . . 0.0 115.751 178.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -75.59 78.51 2.59 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.742 -1.224 . . . . 0.0 110.251 170.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -148.39 174.11 12.39 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.143 1.777 . . . . 0.0 111.105 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.4 p -114.75 147.53 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.121 1.369 . . . . 0.0 109.351 169.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.07 151.84 45.94 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.76 53.7 1.89 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.577 1.551 . . . . 0.0 113.606 -167.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.67 -10.25 62.59 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 125.733 1.635 . . . . 0.0 115.921 172.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.78 170.88 46.36 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.678 1.239 . . . . 0.0 113.601 172.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -121.53 9.28 10.22 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.524 1.53 . . . . 0.0 113.084 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.6 p -74.29 17.77 0.18 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.299 1.84 . . . . 0.0 114.91 -173.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 m -62.78 -24.56 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.93 169.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.97 152.73 15.71 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.78 0.832 . . . . 0.0 111.848 170.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -76.36 79.55 3.11 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 123.062 1.41 . . . . 0.0 110.894 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -63.57 166.75 6.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.645 2.378 . . . . 0.0 110.571 168.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.05 -22.37 64.95 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.535 -1.353 . . . . 0.0 113.998 -171.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 53.8 m -66.73 -47.88 70.93 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.112 0.869 . . . . 0.0 110.45 170.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.16 -45.88 89.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.554 173.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.47 -28.38 69.17 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.179 -0.951 . . . . 0.0 112.127 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 96.8 m -74.47 -38.41 62.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.39 0.676 . . . . 0.0 111.06 172.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -83.17 -32.21 26.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.121 -1.419 . . . . 0.0 114.033 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -46.64 -48.62 48.64 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-N 120.626 1.557 . . . . 0.0 112.77 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -36.3 30.01 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.376 2.051 . . . . 0.0 113.949 172.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -64.11 -34.19 77.47 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.833 -1.167 . . . . 0.0 112.977 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.09 -30.4 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.61 0.641 . . . . 0.0 111.692 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 mt -78.62 -51.17 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.506 0.722 . . . . 0.0 110.585 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.49 -39.3 87.2 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.646 0.778 . . . . 0.0 112.075 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -68.73 -31.05 69.84 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.305 0.642 . . . . 0.0 111.293 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.4 m -73.43 -46.04 50.86 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.086 -1.009 . . . . 0.0 113.223 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.42 68.77 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 121.032 1.742 . . . . 0.0 114.235 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -76.88 -33.79 57.81 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 174.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -132.4 77.56 69.96 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.631 1.172 . . . . 0.0 112.019 172.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -54.13 -11.78 3.07 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 124.972 3.781 . . . . 0.0 117.255 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -27.23 56.75 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.22 1.408 . . . . 0.0 112.527 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt -65.97 157.51 30.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.798 1.239 . . . . 0.0 112.493 -174.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -93.05 133.89 35.74 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 169.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.6 tp -49.81 -32.87 15.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.448 1.499 . . . . 0.0 114.175 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.459 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.1 m-85 -82.8 -10.76 58.72 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.2 p -60.61 -25.79 66.53 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.698 -1.252 . . . . 0.0 111.573 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -72.73 -0.08 12.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.723 1.609 . . . . 0.0 113.944 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.36 -34.18 25.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.649 1.579 . . . . 0.0 111.48 167.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -70.18 -28.8 65.6 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.045 1.338 . . . . 0.0 111.933 -170.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -71.88 -30.28 65.24 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.49 1.516 . . . . 0.0 115.008 175.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -102.88 -35.14 8.71 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -166.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.0 m 62.62 -41.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 127.523 2.329 . . . . 0.0 115.662 -169.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 22.6 t30 66.96 167.0 0.23 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 129.648 3.179 . . . . 0.0 116.318 175.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -72.34 22.39 0.06 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 128.115 2.566 . . . . 0.0 116.945 -167.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.51 151.71 65.78 Favored Pre-proline 0 CA--C 1.55 0.945 0 O-C-N 120.703 -1.248 . . . . 0.0 112.389 172.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.2 161.73 44.89 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.894 2.396 . . . . 0.0 112.104 170.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.254 1.34 0 C-N-CA 125.451 1.501 . . . . 0.0 112.133 -176.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 49.8 t30 56.86 48.9 15.1 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.793 1.637 . . . . 0.0 113.927 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -62.55 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.084 0.954 . . . . 0.0 113.144 169.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 97.63 99.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.891 2.876 . . . . 0.0 116.156 168.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.33 -30.9 67.06 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 120.083 -1.636 . . . . 0.0 111.774 169.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -67.08 -17.85 65.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.085 1.754 . . . . 0.0 115.292 174.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.57 6.29 14.57 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.596 1.158 . . . . 0.0 113.175 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.3 ttm -63.21 125.71 24.99 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.96 -1.087 . . . . 0.0 110.651 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -79.87 155.48 27.78 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.834 -1.166 . . . . 0.0 110.866 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.08 -35.36 78.43 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.116 -1.615 . . . . 0.0 112.862 -174.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.31 -29.42 70.5 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.182 0.901 . . . . 0.0 112.731 173.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -82.45 -35.58 27.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.719 1.608 . . . . 0.0 111.386 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -63.35 -48.55 77.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.789 0.835 . . . . 0.0 112.727 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -67.75 -4.52 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.785 0.834 . . . . 0.0 112.854 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.28 -11.03 15.66 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.487 1.915 . . . . 0.0 114.404 172.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 158.26 36.01 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.653 -1.279 . . . . 0.0 110.83 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -65.41 129.98 94.55 Favored Pre-proline 0 N--CA 1.478 0.941 0 O-C-N 121.207 -0.933 . . . . 0.0 111.534 -178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.75 -18.08 53.78 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.935 2.423 . . . . 0.0 114.808 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -54.5 -66.95 0.31 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.217 1.407 . . . . 0.0 109.521 168.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.55 -9.84 59.69 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.8 ttm -56.26 -43.44 78.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.871 0.868 . . . . 0.0 112.581 171.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 86.6 m -55.85 -54.73 48.75 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.019 -0.991 . . . . 0.0 113.655 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -54.4 -54.2 5.01 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 124.438 3.425 . . . . 0.0 114.073 169.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.13 -31.39 52.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 119.667 -1.896 . . . . 0.0 113.338 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.27 71.16 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.399 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -86.83 -41.1 14.32 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 116.402 -1.761 . . . . 0.0 111.593 175.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.421 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 6.2 m0 -59.74 -22.95 62.77 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 123.356 2.798 . . . . 0.0 113.659 171.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.9 tmm? -76.97 -63.99 1.23 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.43 0.692 . . . . 0.0 111.092 167.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.93 -32.82 74.53 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.639 1.176 . . . . 0.0 113.842 -168.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . 0.492 ' CG ' HD21 ' B' ' 154' ' ' ASN . 0.3 OUTLIER -116.71 -0.32 12.38 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.516 1.526 . . . . 0.0 112.982 -172.002 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 57.95 -1.3 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 118.579 2.807 . . . . 0.0 118.579 169.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 62.42 -67.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.485 1.914 . . . . 0.0 113.581 -171.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' THR . . . . . 0.455 ' C ' ' H ' ' B' ' 114' ' ' TYR 0.252 10.8 t 38.15 46.18 0.83 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.311 2.244 . . . . 0.0 113.96 174.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 2.6 p 52.74 -1.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 129.701 3.201 . . . . 0.0 117.497 -178.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . 0.455 ' H ' ' C ' ' B' ' 112' ' ' THR 0.291 0.5 OUTLIER 58.69 43.3 18.98 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 127.308 2.243 . . . . 0.0 113.817 -170.77 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 46.6 pttt -38.6 123.91 1.27 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.86 2.064 . . . . 0.0 113.196 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 69.93 6.06 54.82 Favored Glycine 0 CA--C 1.54 1.616 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 171.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -146.69 -173.46 17.93 Favored Glycine 0 CA--C 1.536 1.352 0 CA-C-N 120.088 1.944 . . . . 0.0 114.942 -177.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -136.79 -4.69 1.98 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 22.6 p -77.34 43.6 0.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.431 1.893 . . . . 0.0 114.781 -173.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 36.0 m -64.19 -16.94 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 125.27 1.428 . . . . 0.0 113.21 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.16 159.21 4.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.423 1.489 . . . . 0.0 111.684 168.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.22 106.14 3.21 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.051 -1.031 . . . . 0.0 109.433 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -76.35 164.99 25.48 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.323 1.049 . . . . 0.0 109.464 173.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -64.26 -26.1 68.35 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.221 -1.549 . . . . 0.0 112.2 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 11.2 m -63.89 -44.06 94.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.957 169.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -62.72 -49.84 73.47 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.21 0.913 . . . . 0.0 111.003 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 92.0 mt -57.28 -28.35 62.92 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.523 0.729 . . . . 0.0 112.48 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 53.3 m -83.94 -34.69 24.41 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.607 1.163 . . . . 0.0 112.406 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -84.67 -33.34 23.23 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 117.608 -1.187 . . . . 0.0 113.751 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.33 -43.86 92.15 Favored Pre-proline 0 N--CA 1.481 1.11 0 CA-C-N 120.457 1.48 . . . . 0.0 112.871 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.46 -39.07 7.55 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 CA-C-N 122.389 1.889 . . . . 0.0 113.312 171.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.24 -33.91 77.1 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.776 1.171 . . . . 0.0 113.76 -174.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.32 -24.07 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.358 0.663 . . . . 0.0 112.355 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 27.5 mt -73.95 -49.78 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.607 0.763 . . . . 0.0 109.567 170.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -58.51 -41.56 85.7 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.957 0.903 . . . . 0.0 112.258 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.79 -26.16 65.96 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.167 -0.958 . . . . 0.0 112.302 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.2 -47.15 25.09 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.766 0.827 . . . . 0.0 112.215 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -26.86 68.14 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 120.268 1.394 . . . . 0.0 114.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.258 15.1 ptpt -84.13 -10.15 58.01 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -137.56 61.35 30.42 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 111.112 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.65 -14.16 34.19 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.877 3.051 . . . . 0.0 115.679 -168.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -85.57 -14.99 44.07 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 113.657 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -74.43 158.5 33.76 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.199 0.999 . . . . 0.0 111.765 -172.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -92.86 133.7 35.81 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.23 -40.05 46.42 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.914 1.285 . . . . 0.0 114.272 -169.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.257 5.0 m-85 -79.2 -6.84 57.53 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.9 p -61.97 -27.12 68.63 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.694 -1.254 . . . . 0.0 111.176 168.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -72.58 -3.66 26.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.04 1.336 . . . . 0.0 113.943 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -81.38 -29.46 34.01 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.374 0.988 . . . . 0.0 112.036 167.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -68.97 -32.12 71.47 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.747 0.819 . . . . 0.0 112.049 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -69.67 -28.43 65.86 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.16 1.784 . . . . 0.0 115.376 169.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -108.09 106.48 16.72 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -165.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 22.9 t -91.87 96.85 10.62 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 167.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . 0.492 HD21 ' CG ' ' B' ' 109' ' ' HIS . 36.0 t30 -84.04 -167.31 1.7 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.369 1.067 . . . . 0.0 112.563 -171.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.95 -13.2 44.18 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.41 146.71 97.85 Favored Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 124.908 1.283 . . . . 0.0 114.435 -175.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -65.84 160.46 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.178 2.585 . . . . 0.0 113.328 169.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.501 1.12 . . . . 0.0 113.569 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 119.969 -0.062 . . . . 0.0 111.084 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -165.94 113.07 0.91 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.622 1.201 . . . . 0.0 108.611 167.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -166.28 -166.07 0.85 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.341 2.657 . . . . 0.0 106.439 -168.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -134.48 56.76 1.83 Allowed 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 123.675 0.79 . . . . 0.0 110.248 169.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -52.76 -40.97 63.6 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 121.273 1.851 . . . . 0.0 111.475 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.408 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 3.3 ptpt -64.53 -11.04 30.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.511 2.324 . . . . 0.0 116.172 175.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -133.28 21.0 4.02 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.036 1.735 . . . . 0.0 111.727 171.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.3 ttm -62.13 122.65 16.08 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 177.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.6 t -76.96 153.97 34.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.08 -32.61 74.03 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 120.616 -1.302 . . . . 0.0 112.823 -173.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -62.96 -31.13 72.17 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.712 0.805 . . . . 0.0 112.971 170.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.73 -39.41 27.04 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.41 1.484 . . . . 0.0 111.851 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -58.71 -49.76 76.42 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.476 -0.765 . . . . 0.0 113.028 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -67.25 -4.44 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 C-N-CA 123.979 0.912 . . . . 0.0 112.668 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -112.94 -5.48 13.81 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.227 1.811 . . . . 0.0 113.813 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.81 161.98 28.55 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.897 -1.127 . . . . 0.0 110.382 173.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -66.41 128.19 93.71 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 120.899 -1.126 . . . . 0.0 111.611 -174.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.4 -20.81 16.32 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.339 3.359 . . . . 0.0 115.879 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -59.86 -67.07 0.42 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.181 1.792 . . . . 0.0 109.811 168.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.16 -5.29 57.53 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -177.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -60.79 -40.38 92.44 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.1 -1.0 . . . . 0.0 112.674 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.253 23.7 m -65.4 -52.11 47.79 Favored Pre-proline 0 N--CA 1.479 0.993 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -177.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.69 -42.85 42.19 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.558 2.839 . . . . 0.0 116.146 169.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.33 -37.44 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 119.913 1.233 . . . . 0.0 113.087 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.83 -28.62 68.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.781 0.832 . . . . 0.0 111.738 171.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.8 t90 -81.83 -53.77 5.91 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 117.693 -1.146 . . . . 0.0 112.406 170.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.43 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.0 t90 -64.12 -37.81 88.78 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 120.365 1.439 . . . . 0.0 111.281 -167.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -59.08 -31.23 68.71 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.746 1.218 . . . . 0.0 112.615 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.04 -5.1 39.47 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -134.36 -35.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 63.06 168.59 0.14 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.457 1.903 . . . . 0.0 111.599 -165.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.34 35.69 0.15 Allowed 'General case' 0 N--CA 1.481 1.08 0 O-C-N 119.737 -1.852 . . . . 0.0 113.856 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.1 t -76.22 147.98 38.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.414 1.486 . . . . 0.0 112.702 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.8 t -78.9 133.97 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.858 0.863 . . . . 0.0 110.441 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.4 153.97 39.0 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.786 1.634 . . . . 0.0 113.465 -176.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -150.41 157.63 43.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.619 1.568 . . . . 0.0 111.261 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.27 -35.38 0.66 Allowed Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.536 1.541 . . . . 0.0 115.469 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -154.03 -165.59 13.92 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.072 1.796 . . . . 0.0 112.825 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -126.6 20.76 7.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.196 1.798 . . . . 0.0 113.782 -174.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.3 p -76.99 48.79 0.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.315 1.846 . . . . 0.0 114.715 -169.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.97 -14.24 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 O-C-N 121.06 -1.025 . . . . 0.0 112.405 168.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.26 152.21 8.59 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.979 2.111 . . . . 0.0 112.08 168.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -75.85 81.42 2.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 123.068 1.413 . . . . 0.0 110.508 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -59.0 165.1 2.58 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.885 2.474 . . . . 0.0 110.56 168.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.77 -20.64 64.36 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.499 -1.375 . . . . 0.0 113.452 -172.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.4 m -68.29 -43.96 76.52 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.403 1.001 . . . . 0.0 111.287 169.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -60.37 -47.1 87.53 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.556 1.071 . . . . 0.0 111.36 171.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 71.6 mt -64.63 -28.58 69.72 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.118 -0.989 . . . . 0.0 112.369 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 93.6 m -71.8 -41.68 67.98 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.534 0.734 . . . . 0.0 110.841 169.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -75.95 -33.32 59.8 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -175.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.253 1.6 mp -54.21 -41.94 91.27 Favored Pre-proline 0 CA--C 1.554 1.116 0 CA-C-N 119.694 1.134 . . . . 0.0 112.654 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.95 -36.81 5.57 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.193 1.929 . . . . 0.0 113.823 169.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -64.17 -33.43 75.77 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.16 1.345 . . . . 0.0 113.74 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.37 -23.53 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 118.773 0.715 . . . . 0.0 112.809 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.2 mt -80.02 -52.2 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.165 0.986 . . . . 0.0 110.189 173.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -54.33 -51.77 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.817 0.847 . . . . 0.0 110.489 175.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -64.73 -25.6 68.0 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.434 -0.791 . . . . 0.0 112.31 -178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.83 -48.78 14.1 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.996 -1.002 . . . . 0.0 113.134 172.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -27.58 69.08 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 121.485 1.948 . . . . 0.0 113.851 174.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -70.22 -29.17 65.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.829 1.651 . . . . 0.0 114.032 168.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -133.91 69.91 74.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.706 1.202 . . . . 0.0 112.304 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -55.41 -16.57 14.13 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.232 2.621 . . . . 0.0 116.356 -176.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -85.65 -27.03 25.66 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -64.33 161.3 17.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.156 0.982 . . . . 0.0 112.661 -175.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -81.22 142.0 33.61 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.856 -0.527 . . . . 0.0 110.1 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.87 -35.81 69.33 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.018 0.927 . . . . 0.0 113.34 171.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.408 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -84.85 -28.25 26.18 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -171.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.2 t -62.48 -17.35 59.35 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.132 -0.98 . . . . 0.0 112.085 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -62.66 -6.63 3.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 119.722 -1.861 . . . . 0.0 113.929 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.09 72.5 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.239 1.416 . . . . 0.0 111.665 167.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -30.77 67.46 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -167.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -73.3 -30.16 63.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.814 1.246 . . . . 0.0 113.854 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -106.01 104.2 13.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.449 1.1 . . . . 0.0 112.183 -167.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.4 p -59.44 -37.72 78.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 58.98 179.76 0.08 Allowed 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 126.922 2.089 . . . . 0.0 114.175 -176.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -69.63 -25.74 64.08 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -169.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.3 152.74 85.99 Favored Pre-proline 0 CA--C 1.555 1.147 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -72.73 157.47 51.98 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.819 2.346 . . . . 0.0 111.303 167.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.096 171.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 120.343 0.116 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.289 8.4 t-20 66.96 42.85 2.34 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 172.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -78.92 161.34 26.77 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 163.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -92.97 95.59 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.752 -1.218 . . . . 0.0 113.786 -166.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.88 -36.77 59.61 Favored 'General case' 0 CA--C 1.558 1.277 0 O-C-N 121.16 -0.962 . . . . 0.0 109.932 168.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.405 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 25.2 mtmt -67.99 -12.71 61.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 128.89 2.876 . . . . 0.0 116.284 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -133.21 19.04 4.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.5 ttm -59.78 123.85 18.27 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 169.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -78.04 154.64 31.23 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.34 -0.85 . . . . 0.0 110.327 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.0 m -61.45 -35.09 76.63 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 120.482 -1.386 . . . . 0.0 112.596 -173.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -65.64 -32.33 73.85 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.306 0.957 . . . . 0.0 112.725 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -76.23 -37.83 57.18 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.03 1.332 . . . . 0.0 111.344 174.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -63.95 -49.43 72.6 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.944 0.898 . . . . 0.0 112.614 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.19 -2.99 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -110.79 -8.59 14.53 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.606 1.962 . . . . 0.0 114.089 172.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.6 156.89 35.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.747 1.158 . . . . 0.0 110.177 172.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -66.43 127.53 93.37 Favored Pre-proline 0 N--CA 1.479 0.986 0 O-C-N 121.3 -0.875 . . . . 0.0 109.662 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -46.77 -32.18 11.82 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.683 2.922 . . . . 0.0 113.819 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 57.8 mttt -60.11 -13.82 13.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -132.94 22.59 4.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 121.421 1.919 . . . . 0.0 113.123 165.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ttm -67.57 -54.77 17.11 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.677 1.191 . . . . 0.0 111.295 170.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.0 m -48.09 -55.7 17.04 Favored Pre-proline 0 N--CA 1.49 1.54 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.68 -45.42 40.49 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.124 3.216 . . . . 0.0 115.543 174.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.32 -39.99 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.391 1.451 . . . . 0.0 112.935 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.23 -31.86 71.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.185 0.594 . . . . 0.0 110.68 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 67.3 t90 -78.78 -48.61 14.49 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.541 172.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.41 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.7 t90 -64.67 -25.88 68.14 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 117.888 -1.525 . . . . 0.0 110.957 -171.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -62.0 -60.38 3.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.118 1.367 . . . . 0.0 111.17 167.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -27.56 67.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.143 1.377 . . . . 0.0 113.423 -170.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -108.97 5.2 24.06 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 59.52 156.75 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.186 2.594 . . . . 0.0 117.834 -177.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -73.65 -9.69 58.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.56 1.544 . . . . 0.0 112.526 171.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 72.7 p -71.04 162.48 29.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.717 1.607 . . . . 0.0 113.186 -176.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -87.03 148.49 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.403 1.081 . . . . 0.0 110.754 -178.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -80.26 161.83 24.92 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -174.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -136.95 140.72 42.44 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.034 1.734 . . . . 0.0 110.844 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.31 -66.07 0.74 Allowed Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.44 1.019 . . . . 0.0 113.36 -172.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 160.99 125.81 0.79 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.935 1.731 . . . . 0.0 111.522 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -92.63 -13.65 29.27 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.807 0.803 . . . . 0.0 112.817 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 19.4 m 50.4 57.28 6.77 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -166.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 13.0 t -41.8 96.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 127.129 2.172 . . . . 0.0 113.378 -167.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.3 p -144.69 155.08 43.39 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 126.034 1.733 . . . . 0.0 109.201 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 24.0 tp -79.4 74.79 6.01 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.757 1.265 . . . . 0.0 109.728 169.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -58.03 161.25 4.17 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 128.535 2.734 . . . . 0.0 113.795 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -71.03 -22.75 62.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 58.7 m -63.93 -48.23 77.37 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.149 0.886 . . . . 0.0 110.492 171.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.48 -51.9 67.89 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.781 0.719 . . . . 0.0 111.608 171.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.02 -30.44 61.88 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.1 m -81.91 -33.87 30.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.811 0.845 . . . . 0.0 112.347 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -83.17 -31.94 26.86 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.766 -1.112 . . . . 0.0 113.76 -177.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.82 -47.03 86.92 Favored Pre-proline 0 N--CA 1.481 1.1 0 CA-C-N 120.433 1.47 . . . . 0.0 113.038 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.31 -37.64 17.37 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 122.208 1.824 . . . . 0.0 113.318 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -65.42 -36.83 85.11 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.776 -1.203 . . . . 0.0 113.152 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 m -73.25 -28.44 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.777 -0.577 . . . . 0.0 112.49 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 49.7 mt -66.17 -49.23 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-N 118.191 0.45 . . . . 0.0 109.894 170.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.31 -41.61 80.24 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.406 0.683 . . . . 0.0 111.904 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -66.6 -27.53 67.78 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.517 -0.74 . . . . 0.0 112.923 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -76.07 -48.36 21.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.846 0.858 . . . . 0.0 112.184 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -26.47 68.28 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.979 1.263 . . . . 0.0 114.294 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.279 15.2 ptpt -83.73 -10.45 58.12 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 169.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -138.32 61.73 27.35 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.655 1.582 . . . . 0.0 111.439 174.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.81 -14.63 33.16 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.801 3.001 . . . . 0.0 115.847 -169.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -84.99 -14.54 47.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 113.681 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -77.33 160.09 29.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.681 1.192 . . . . 0.0 112.147 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -77.84 139.83 39.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.551 -0.718 . . . . 0.0 109.3 169.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -54.18 -35.76 62.66 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.089 0.956 . . . . 0.0 112.875 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.405 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -87.16 -23.03 24.96 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -170.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.1 t -64.24 -14.61 56.72 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 120.771 -1.206 . . . . 0.0 112.018 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -66.06 -5.17 8.87 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.487 -2.008 . . . . 0.0 114.18 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.01 -30.05 49.84 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 119.929 1.241 . . . . 0.0 111.565 166.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -64.98 -33.68 76.61 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.921 1.289 . . . . 0.0 112.037 -171.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -73.07 -28.8 62.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.528 1.931 . . . . 0.0 115.647 173.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -101.78 109.63 21.43 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -166.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.4 m -78.76 80.58 5.12 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.301 -0.874 . . . . 0.0 110.27 168.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -71.56 176.8 4.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.301 1.04 . . . . 0.0 112.667 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -66.78 -3.73 7.43 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 116.809 2.152 . . . . 0.0 116.809 -168.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.42 145.9 98.19 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 176.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -64.11 156.61 58.07 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.063 2.509 . . . . 0.0 113.614 170.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.602 1.561 . . . . 0.0 111.084 178.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.004 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.254 7.3 t-20 58.23 45.39 17.36 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.52 1.528 . . . . 0.0 114.406 174.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.48 ' HB3' ' HE3' ' B' ' 98' ' ' LYS . 20.2 mm-40 -56.38 -22.74 33.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.802 1.241 . . . . 0.0 113.164 168.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 101.92 100.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 129.462 3.105 . . . . 0.0 114.919 168.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.73 -33.55 73.07 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.313 -1.492 . . . . 0.0 112.588 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.3 ptpt -74.31 -12.46 60.55 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -106.02 6.08 30.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.452 1.101 . . . . 0.0 112.594 168.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 43.0 ttm -62.02 129.31 40.3 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.724 -1.235 . . . . 0.0 109.722 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.88 155.12 27.92 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.049 -1.032 . . . . 0.0 110.481 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.88 -32.61 74.19 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.264 -1.522 . . . . 0.0 113.417 -175.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.86 -31.47 71.74 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -81.22 -35.0 31.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.39 1.476 . . . . 0.0 111.53 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -57.94 -50.45 73.31 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 121.562 -0.711 . . . . 0.0 112.658 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -69.57 -0.66 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 125.262 1.425 . . . . 0.0 113.042 177.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -111.54 -11.28 14.08 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.351 1.46 . . . . 0.0 114.318 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.42 165.99 24.04 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.188 -0.945 . . . . 0.0 111.622 174.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -65.74 128.72 94.02 Favored Pre-proline 0 N--CA 1.483 1.191 0 O-C-N 120.941 -1.099 . . . . 0.0 112.542 -177.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -57.65 -12.74 12.15 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.556 3.504 . . . . 0.0 116.521 177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 9.3 mttt -65.75 -67.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.029 1.731 . . . . 0.0 109.672 166.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.64 -6.47 52.18 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 73.6 mtp -57.06 -30.74 64.53 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 121.009 -1.057 . . . . 0.0 112.155 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.267 23.7 m -68.15 -56.1 11.62 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.67 -36.62 82.09 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 123.173 2.582 . . . . 0.0 114.768 168.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 66.2 t -63.74 -53.97 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.504 0.593 . . . . 0.0 111.067 175.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.3 71.37 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.786 1.235 . . . . 0.0 111.685 -177.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.0 t90 -77.68 -52.74 8.49 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 117.575 -1.203 . . . . 0.0 113.459 169.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.494 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 3.0 t90 -66.44 -34.22 77.45 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.761 1.619 . . . . 0.0 111.886 -167.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 58.0 ttp -54.3 -44.2 71.78 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.958 0.903 . . . . 0.0 112.115 169.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.22 -32.67 44.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.281 1.432 . . . . 0.0 112.909 -171.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -121.13 -16.71 7.93 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 62.38 170.67 0.13 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.76 2.6 35.84 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.596 2.358 . . . . 0.0 112.505 172.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.0 p -65.79 14.81 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 128.205 2.602 . . . . 0.0 116.445 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.5 t 61.61 127.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 129.123 2.969 . . . . 0.0 114.26 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.64 156.07 37.71 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.02 0.928 . . . . 0.0 111.825 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.9 mmpt? -82.83 0.86 42.03 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -169.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.71 -25.47 0.1 OUTLIER Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.551 1.072 . . . . 0.0 114.962 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.97 -178.36 50.02 Favored Glycine 0 CA--C 1.538 1.519 0 CA-C-N 118.279 1.039 . . . . 0.0 114.827 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -124.88 24.5 7.62 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.557 1.943 . . . . 0.0 112.453 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.0 m -75.52 65.29 1.73 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.784 1.633 . . . . 0.0 113.508 -168.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -67.56 -15.54 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.667 1.187 . . . . 0.0 112.545 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.39 136.62 53.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.277 1.831 . . . . 0.0 111.727 175.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.8 tp -78.43 77.77 4.91 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.733 1.254 . . . . 0.0 109.839 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -61.11 165.82 4.05 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.857 2.863 . . . . 0.0 113.216 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.83 -24.01 65.23 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.78 -1.2 . . . . 0.0 113.985 -172.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.6 m -65.11 -47.63 76.51 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 119.363 0.983 . . . . 0.0 110.656 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.53 -47.4 84.31 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.897 0.771 . . . . 0.0 111.185 172.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.5 mt -64.24 -25.24 67.97 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.892 -1.13 . . . . 0.0 112.219 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.8 m -77.83 -35.49 51.11 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.701 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -88.49 -27.81 21.23 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.06 -43.64 85.18 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.913 174.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.69 -40.36 10.13 Favored 'Trans proline' 0 C--N 1.352 0.726 0 CA-C-N 122.16 1.807 . . . . 0.0 113.572 169.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -63.35 -37.23 86.48 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.954 1.252 . . . . 0.0 112.928 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 m -68.97 -28.38 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -72.31 -51.43 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 173.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.99 -43.09 77.31 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.141 0.977 . . . . 0.0 111.415 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.29 -30.49 69.51 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.831 -0.543 . . . . 0.0 111.375 -177.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.77 -42.7 57.67 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.11 -0.994 . . . . 0.0 112.807 174.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -31.08 68.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.764 1.62 . . . . 0.0 114.284 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -82.6 -25.71 32.97 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -130.9 73.95 80.5 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.767 1.627 . . . . 0.0 110.603 170.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.52 -11.45 16.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.731 3.621 . . . . 0.0 115.722 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -81.92 -25.14 35.18 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.806 1.642 . . . . 0.0 112.613 -175.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -66.41 154.61 39.69 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.114 0.966 . . . . 0.0 111.395 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -89.62 127.42 35.9 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 174.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.26 -51.5 10.77 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -166.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.443 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -70.92 -6.74 40.75 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.5 p -56.74 -28.21 60.69 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 120.75 -1.219 . . . . 0.0 110.969 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -71.16 -2.26 15.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.515 1.526 . . . . 0.0 114.307 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -83.41 -31.08 26.85 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 111.811 167.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -69.5 -28.69 66.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 111.94 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -75.63 -31.53 59.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.624 1.57 . . . . 0.0 114.988 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -116.28 93.9 4.42 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 112.425 -166.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.3 m -56.99 -42.44 80.26 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.656 1.183 . . . . 0.0 113.339 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.6 t30 61.66 172.55 0.12 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 128.059 2.544 . . . . 0.0 115.737 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -80.23 42.15 0.56 Allowed 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 -167.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -73.53 -33.33 1.84 Allowed Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 174.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -79.83 144.58 17.31 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.669 2.913 . . . . 0.0 114.045 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.584 2.258 0 C-N-CA 125.766 1.626 . . . . 0.0 108.24 171.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.875 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 45.2 t30 55.87 69.21 0.76 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.243 1.817 . . . . 0.0 113.633 -176.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.409 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 20.8 mm-40 -64.1 -9.97 19.69 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.03 1.332 . . . . 0.0 114.019 169.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m 117.99 78.91 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 130.885 3.674 . . . . 0.0 112.665 170.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.4 -39.37 70.11 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.156 -1.59 . . . . 0.0 111.905 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.454 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 2.3 ptpt -78.82 3.63 16.24 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -124.97 9.88 8.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.8 1.24 . . . . 0.0 112.2 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 37.6 ttm -61.5 124.7 21.37 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.476 1.034 . . . . 0.0 109.427 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -76.69 153.24 35.31 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.757 -0.589 . . . . 0.0 110.008 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.93 -28.27 68.16 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.323 -1.486 . . . . 0.0 113.88 -170.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -67.23 -31.85 72.48 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 118.806 0.73 . . . . 0.0 112.551 169.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -75.71 -37.96 59.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.004 1.322 . . . . 0.0 111.28 176.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -67.85 -4.83 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.99 -10.34 17.29 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.957 1.703 . . . . 0.0 113.886 172.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.67 157.77 37.4 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.81 1.187 . . . . 0.0 111.199 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.64 134.75 89.23 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 123.603 0.761 . . . . 0.0 113.036 -178.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -72.59 -7.19 20.42 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.719 1.612 . . . . 0.0 115.947 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.48 ' HE3' ' HB3' ' A' ' 3' ' ' GLU . 6.3 mptt -71.3 -53.79 13.05 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.926 1.694 . . . . 0.0 108.712 167.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.32 -15.6 54.92 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 36.3 ttm -54.03 -33.33 57.01 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.636 -0.665 . . . . 0.0 112.6 172.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 30.9 m -65.4 -58.24 12.59 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.773 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -51.79 -41.98 59.64 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 124.053 3.168 . . . . 0.0 115.033 172.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.92 -42.49 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.637 1.108 . . . . 0.0 113.034 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.69 -29.08 69.85 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.2 t90 -77.56 -51.9 9.93 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 117.728 -1.13 . . . . 0.0 112.16 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -65.84 -29.24 69.67 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.801 1.637 . . . . 0.0 111.21 -169.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 2.8 ttp -65.82 -39.25 90.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.726 1.61 . . . . 0.0 111.895 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -79.1 -34.91 43.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.543 1.137 . . . . 0.0 112.43 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.52 -26.86 27.79 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.168 -1.583 . . . . 0.0 114.239 170.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 70.48 142.62 0.05 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.559 2.344 . . . . 0.0 114.157 -170.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.28 -8.54 57.3 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 7.2 p -62.29 143.66 56.61 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.901 1.28 . . . . 0.0 111.996 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.5 p -70.64 141.35 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -168.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 7.0 m-30 -75.27 171.48 14.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.655 1.582 . . . . 0.0 113.274 -175.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -115.19 26.9 9.76 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.103 1.761 . . . . 0.0 112.635 -169.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.78 -2.21 66.56 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 126.501 2.001 . . . . 0.0 115.228 -174.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.02 166.23 52.72 Favored Glycine 0 CA--C 1.538 1.484 0 CA-C-N 118.524 1.162 . . . . 0.0 114.221 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -111.69 22.09 15.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.861 1.665 . . . . 0.0 113.927 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 14.3 p -71.47 33.72 0.05 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 127.232 2.213 . . . . 0.0 114.625 -175.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 28.8 m -80.95 -4.51 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 O-C-N 120.295 -1.503 . . . . 0.0 112.05 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 22.4 p -66.06 156.7 33.05 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.187 2.195 . . . . 0.0 113.02 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 mp -93.91 149.17 21.46 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.115 0.966 . . . . 0.0 108.795 168.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -143.68 174.66 10.6 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.139 0.976 . . . . 0.0 112.96 -169.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.67 -32.93 73.14 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.098 0.959 . . . . 0.0 113.403 -174.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 65.9 m -70.54 -50.31 38.93 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.717 -0.614 . . . . 0.0 110.174 172.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.25 -55.11 37.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.958 0.903 . . . . 0.0 112.658 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 pp -62.05 -27.27 68.78 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 21.8 m -81.28 -31.49 33.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 122.502 0.321 . . . . 0.0 111.504 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -84.06 -26.1 29.31 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.389 -1.291 . . . . 0.0 114.472 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.16 -42.28 79.81 Favored Pre-proline 0 N--CA 1.482 1.15 0 CA-C-N 121.533 1.969 . . . . 0.0 113.983 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.44 -36.02 5.71 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 CA-C-N 122.487 1.924 . . . . 0.0 113.255 169.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -67.88 -30.78 70.23 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.697 -1.252 . . . . 0.0 113.923 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.0 m -70.9 -31.21 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.989 0.813 . . . . 0.0 111.431 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -68.15 -50.66 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 109.864 171.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -55.19 -44.65 75.48 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.852 0.861 . . . . 0.0 111.571 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.17 -37.03 84.64 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.458 1.026 . . . . 0.0 111.888 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.9 -36.66 78.31 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.456 -0.777 . . . . 0.0 112.189 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -58.3 -51.21 70.73 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.43 1.492 . . . . 0.0 112.648 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 pttt -84.87 -21.58 29.71 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -128.92 76.87 78.65 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.896 1.679 . . . . 0.0 109.672 170.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.09 -9.69 22.72 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.895 3.064 . . . . 0.0 114.957 -176.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -81.96 -21.44 37.2 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.312 1.445 . . . . 0.0 112.833 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -70.37 159.65 33.75 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.441 1.097 . . . . 0.0 111.992 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -92.66 130.26 38.35 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 169.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 65.6 tp -45.33 -47.41 13.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.999 1.32 . . . . 0.0 114.244 -172.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.454 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -72.53 -8.76 56.79 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -174.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 70.3 p -60.53 -24.53 65.44 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.677 -1.264 . . . . 0.0 111.61 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -72.43 -1.18 14.7 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.831 1.253 . . . . 0.0 114.26 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -80.73 -31.85 35.89 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.663 1.12 . . . . 0.0 111.572 165.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -68.75 -29.05 67.37 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.709 1.204 . . . . 0.0 112.465 -169.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.94 -30.01 68.37 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 114.115 169.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -93.44 -45.66 7.68 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 44.2 m 48.27 32.12 2.99 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 125.955 1.702 . . . . 0.0 114.95 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -89.89 163.22 15.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.855 2.062 . . . . 0.0 114.121 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 59.39 -6.6 0.06 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 118.239 2.681 . . . . 0.0 118.239 168.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -147.82 159.84 39.65 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 126.832 2.053 . . . . 0.0 110.845 170.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -62.51 153.47 71.03 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.97 2.447 . . . . 0.0 114.399 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.123 1.769 . . . . 0.0 111.878 178.453 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 121.321 0.582 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.281 46.0 t30 60.29 44.77 12.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.373 1.869 . . . . 0.0 115.583 175.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -67.21 -22.36 65.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.399 164.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.5 m 90.69 99.76 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 129.685 3.194 . . . . 0.0 117.808 165.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.99 -32.4 66.06 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 119.87 -1.769 . . . . 0.0 111.861 169.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.406 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 32.0 mttt -58.92 -22.81 60.44 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 126.989 2.116 . . . . 0.0 114.86 175.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -119.29 6.01 11.2 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.895 1.678 . . . . 0.0 112.756 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -61.84 127.41 31.27 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.924 -1.11 . . . . 0.0 109.755 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.58 155.19 28.26 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.292 -0.88 . . . . 0.0 110.022 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.39 -33.84 76.43 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 120.454 -1.404 . . . . 0.0 113.187 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -64.09 -32.24 73.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.774 0.716 . . . . 0.0 112.881 172.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -77.22 -38.18 51.79 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.885 1.274 . . . . 0.0 111.836 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -59.09 -50.37 74.31 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.818 0.847 . . . . 0.0 112.438 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.1 pt -68.36 -5.07 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 124.454 1.102 . . . . 0.0 112.925 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -105.75 -8.98 17.5 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.735 1.614 . . . . 0.0 113.543 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.14 157.89 33.94 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 119.758 1.163 . . . . 0.0 110.462 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -66.83 129.74 94.03 Favored Pre-proline 0 N--CA 1.482 1.132 0 O-C-N 121.216 -0.927 . . . . 0.0 111.426 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -52.17 -27.82 31.18 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.385 2.723 . . . . 0.0 115.019 177.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -51.32 -66.5 0.37 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.769 1.628 . . . . 0.0 111.078 170.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.255 . . -83.07 -4.55 58.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 178.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.2 ttt -64.65 -36.55 84.61 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.857 -1.152 . . . . 0.0 112.211 168.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.9 m -60.45 -51.83 77.22 Favored Pre-proline 0 N--CA 1.478 0.939 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.43 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 10.0 Cg_endo -54.94 -46.3 34.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.16 2.573 . . . . 0.0 115.309 169.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.96 -35.52 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 119.765 1.166 . . . . 0.0 113.154 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.12 -18.34 64.33 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.45 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.2 t90 -95.69 -48.6 5.72 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.181 0.901 . . . . 0.0 111.665 168.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.512 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 56.6 t-105 -64.24 -34.58 78.43 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.563 1.145 . . . . 0.0 111.922 -170.253 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.2 tmm? -67.18 -46.78 72.93 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 124.831 1.252 . . . . 0.0 111.385 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -66.61 -35.1 79.37 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.775 1.23 . . . . 0.0 112.749 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -98.25 -4.05 36.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 32' ' ' GLU . 5.7 tt0 57.08 -179.53 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.883 1.673 . . . . 0.0 113.654 -169.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.412 ' H ' ' HG2' ' A' ' 31' ' ' GLU . 12.1 pt-20 -73.62 41.67 0.12 Allowed 'General case' 0 CA--C 1.555 1.158 0 O-C-N 120.069 -1.645 . . . . 0.0 113.006 172.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 13.5 t -69.58 153.95 42.71 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.133 1.773 . . . . 0.0 114.62 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.42 -4.71 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.454 1.501 . . . . 0.0 113.373 168.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.5 t80 67.15 27.66 8.44 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 53.46 30.65 10.85 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 126.361 1.865 . . . . 0.0 114.498 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.88 1.85 88.73 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.429 1.49 . . . . 0.0 115.254 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.78 -176.61 51.56 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 119.072 1.436 . . . . 0.0 114.076 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -134.11 -14.93 2.31 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -78.71 44.75 0.55 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.941 2.097 . . . . 0.0 114.138 -169.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.63 14.53 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 126.257 1.823 . . . . 0.0 114.465 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.64 152.25 22.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.458 2.303 . . . . 0.0 113.189 -176.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.3 mp -77.12 72.98 3.7 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.508 1.523 . . . . 0.0 110.173 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -67.12 165.64 15.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.935 2.494 . . . . 0.0 112.892 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -67.84 -26.45 66.06 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.085 -1.634 . . . . 0.0 113.47 -171.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.6 m -65.77 -47.86 73.76 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.41 -0.807 . . . . 0.0 110.431 169.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.1 -48.0 76.99 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.615 -0.678 . . . . 0.0 111.198 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.1 -27.37 69.35 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.056 -1.027 . . . . 0.0 112.436 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.0 m -76.39 -35.39 58.65 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.405 1.082 . . . . 0.0 111.615 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.53 -28.17 31.21 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.453 1.024 . . . . 0.0 113.642 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.256 1.5 mp -52.93 -40.68 80.45 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.301 1.41 . . . . 0.0 113.628 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.44 -37.01 3.47 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 122.225 1.83 . . . . 0.0 113.175 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -64.57 -34.3 77.94 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.302 -1.499 . . . . 0.0 113.65 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.74 -15.85 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 174.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.0 mt -91.38 -51.27 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.456 1.102 . . . . 0.0 110.663 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.5 -48.39 71.92 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.942 0.897 . . . . 0.0 110.321 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -65.26 -23.57 67.08 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.282 -0.886 . . . . 0.0 112.62 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.7 -48.42 13.7 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.309 0.959 . . . . 0.0 112.668 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.8 -27.17 69.0 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 120.851 1.66 . . . . 0.0 113.892 174.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -72.5 -31.0 65.01 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.67 1.588 . . . . 0.0 114.884 169.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -130.81 64.52 73.84 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.173 1.389 . . . . 0.0 111.369 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -59.51 -14.87 27.54 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 124.267 3.311 . . . . 0.0 115.726 -172.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -84.61 -20.85 30.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.604 1.562 . . . . 0.0 113.797 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -73.46 162.27 29.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.993 1.317 . . . . 0.0 112.248 -172.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -77.68 154.1 32.45 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.923 -0.486 . . . . 0.0 110.04 169.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.36 -36.7 77.1 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.28 -0.887 . . . . 0.0 113.382 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.406 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.3 m-85 -88.05 -21.09 24.95 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 -168.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.3 t -59.16 -22.17 60.53 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.285 -0.884 . . . . 0.0 111.549 170.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -58.67 -16.46 16.4 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 119.555 -1.966 . . . . 0.0 113.394 171.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -58.07 -34.57 70.27 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.31 0.959 . . . . 0.0 112.473 167.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -25.6 67.98 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.962 0.887 . . . . 0.0 112.303 -169.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.344 2.258 . . . . 0.0 113.616 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.24 126.36 46.53 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.083 1.353 . . . . 0.0 112.731 -166.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.2 p -109.05 -8.08 15.24 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -173.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -89.01 13.39 13.03 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.58 17.88 0.49 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -171.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -161.73 160.01 22.63 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.752 2.021 . . . . 0.0 111.719 -177.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -59.66 156.21 38.54 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.34 2.694 . . . . 0.0 113.149 169.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 47.0 t30 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 125.626 1.57 . . . . 0.0 111.877 177.371 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.986 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 65.73 -64.68 0.19 Allowed 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.433 3.093 . . . . 0.0 113.404 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.321 33.3 mm-40 58.57 -26.23 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -170.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 70.7 m 107.48 79.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 131.205 3.802 . . . . 0.0 114.017 167.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.7 -41.49 61.49 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 121.068 -1.02 . . . . 0.0 110.837 172.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.442 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 13.8 mtmt -63.19 -15.1 55.86 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.299 2.239 . . . . 0.0 115.809 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -123.85 7.72 8.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.456 1.502 . . . . 0.0 112.799 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 31.0 ttm -59.6 125.25 22.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.765 1.166 . . . . 0.0 109.353 174.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.56 153.76 33.03 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 -178.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.93 -32.49 73.79 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.427 -1.421 . . . . 0.0 112.8 -173.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -66.52 -30.88 71.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.968 0.804 . . . . 0.0 112.89 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -77.5 -38.69 48.51 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.794 1.238 . . . . 0.0 111.315 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.76 -51.27 70.46 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.486 0.714 . . . . 0.0 112.316 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.2 pt -68.27 -3.29 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.832 0.853 . . . . 0.0 112.861 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -105.72 -9.12 17.45 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 126.053 1.741 . . . . 0.0 114.112 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.57 158.13 36.76 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.828 1.195 . . . . 0.0 111.065 174.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -67.82 132.49 92.39 Favored Pre-proline 0 N--CA 1.485 1.283 0 O-C-N 121.04 -1.037 . . . . 0.0 112.128 -173.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -57.29 -16.91 24.15 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.829 3.019 . . . . 0.0 115.829 175.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 33.2 mttt -61.89 -64.11 1.04 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.0 1.72 . . . . 0.0 109.458 166.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.2 -4.18 56.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -177.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.8 mmt -52.42 -45.42 65.93 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.61 1.096 . . . . 0.0 111.704 168.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 83.3 m -60.88 -52.8 69.74 Favored Pre-proline 0 N--CA 1.48 1.05 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.877 -172.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -49.87 -49.46 15.96 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.232 3.288 . . . . 0.0 115.202 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.2 p -72.4 -36.41 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 119.485 1.039 . . . . 0.0 112.934 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.98 67.43 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.518 1.127 . . . . 0.0 111.35 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.523 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.6 t90 -84.21 -53.83 5.23 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 117.826 -1.083 . . . . 0.0 110.883 166.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.523 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.9 t90 -62.29 -33.03 73.87 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 116.495 -2.082 . . . . 0.0 113.159 -164.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -59.72 -42.57 93.38 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.225 1.01 . . . . 0.0 112.635 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 -31.51 67.13 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.525 1.93 . . . . 0.0 112.435 -172.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -104.85 -12.31 16.33 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 174.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . 0.402 ' C ' ' H ' ' B' ' 112' ' ' THR . 26.6 mt-10 64.37 166.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.219 2.208 . . . . 0.0 114.457 -168.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.43 20.94 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.188 1.395 . . . . 0.0 113.834 170.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' THR . . . . . 0.402 ' H ' ' C ' ' B' ' 110' ' ' GLU . 3.4 t -65.56 170.19 5.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.185 1.394 . . . . 0.0 113.792 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 8.7 p -103.82 147.61 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.074 1.75 . . . . 0.0 108.171 170.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . 0.253 0.5 OUTLIER -77.6 158.87 29.59 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 115.267 1.581 . . . . 0.0 115.267 -168.101 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 5.5 ptpt -149.41 149.35 30.68 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.207 1.403 . . . . 0.0 112.504 -169.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 67.88 5.16 37.84 Favored Glycine 0 CA--C 1.542 1.725 0 N-CA-C 116.589 1.396 . . . . 0.0 116.589 175.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 161.58 -157.88 29.62 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.165 1.364 . . . . 0.0 112.795 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -119.76 15.84 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.472 1.909 . . . . 0.0 113.591 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.57 35.19 0.08 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.684 1.994 . . . . 0.0 114.893 -169.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 34.2 m -64.98 -12.63 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 120.918 -1.114 . . . . 0.0 112.656 169.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.41 145.12 11.82 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.168 1.787 . . . . 0.0 111.703 168.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 70.2 mt -78.78 127.41 32.01 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.589 -0.694 . . . . 0.0 110.699 175.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . 0.435 ' ND2' HD22 ' B' ' 154' ' ' ASN . 18.0 m-80 -92.98 163.87 13.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.773 1.629 . . . . 0.0 110.371 -178.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -63.12 -27.26 69.26 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.589 -1.319 . . . . 0.0 112.05 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 81.2 m -58.77 -41.75 87.35 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.047 0.939 . . . . 0.0 111.21 168.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -72.69 -45.5 58.52 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.653 -0.654 . . . . 0.0 109.995 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -56.32 -30.18 62.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.385 0.674 . . . . 0.0 112.259 173.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.6 m -79.7 -39.4 31.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.222 1.009 . . . . 0.0 112.092 172.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -70.89 -36.67 72.85 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.512 -1.368 . . . . 0.0 113.545 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.97 -41.95 90.66 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.592 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -76.0 -35.47 2.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.094 1.863 . . . . 0.0 113.653 169.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -67.22 -28.05 67.74 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.189 -1.569 . . . . 0.0 114.166 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.1 m -71.2 -24.72 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.843 -0.536 . . . . 0.0 112.035 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 36.7 mt -74.22 -47.95 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.196 0.999 . . . . 0.0 109.965 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -54.65 -48.27 72.51 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.745 0.818 . . . . 0.0 112.029 172.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -68.0 -24.74 65.16 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.792 -1.193 . . . . 0.0 112.151 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -76.54 -47.67 21.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 118.422 -0.799 . . . . 0.0 112.626 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 120.826 1.648 . . . . 0.0 114.047 176.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -69.45 -30.37 68.27 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 167.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -133.7 64.79 69.11 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.975 1.31 . . . . 0.0 112.395 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -58.7 -16.73 32.16 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.101 2.534 . . . . 0.0 116.704 -170.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -83.24 -15.02 51.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.998 1.319 . . . . 0.0 113.347 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.04 162.36 28.11 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.891 1.277 . . . . 0.0 112.007 -172.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -76.98 157.09 31.45 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -73.0 -48.45 36.23 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 174.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.442 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 5.1 m-85 -77.86 -18.06 56.66 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 116.161 1.911 . . . . 0.0 116.161 -168.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.2 t -58.88 -24.2 61.93 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.383 -0.823 . . . . 0.0 111.686 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -61.51 -4.1 1.22 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 119.787 -1.82 . . . . 0.0 114.242 171.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -71.21 -31.92 68.17 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.705 1.139 . . . . 0.0 112.168 166.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -63.11 -34.13 76.95 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -168.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -70.13 -26.27 63.87 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.824 2.05 . . . . 0.0 114.766 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -99.95 109.8 22.14 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.432 1.493 . . . . 0.0 113.204 -168.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 27.1 m -93.83 0.51 56.28 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -174.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . 0.435 HD22 ' ND2' ' B' ' 123' ' ' ASN . 48.3 t30 -82.42 7.41 14.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -170.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -76.71 -1.76 29.51 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -149.26 153.28 37.41 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.074 2.15 . . . . 0.0 110.589 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.69 156.62 64.89 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.124 2.549 . . . . 0.0 112.402 171.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.257 0 C-N-CA 125.51 1.524 . . . . 0.0 111.275 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.307 7.5 t-20 65.91 30.22 9.95 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 170.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -58.89 -36.56 74.87 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.689 0.796 . . . . 0.0 110.163 165.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t 80.26 117.5 0.06 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.601 2.761 . . . . 0.0 117.439 167.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.16 -25.41 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.314 -0.866 . . . . 0.0 113.17 175.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -59.82 -30.26 68.8 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.603 1.561 . . . . 0.0 113.097 177.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -107.6 4.62 26.12 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.062 1.745 . . . . 0.0 113.144 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.1 ttm -64.62 124.84 22.93 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.855 -1.153 . . . . 0.0 110.374 175.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.81 155.68 27.75 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.013 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -62.35 -34.38 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.57 -1.331 . . . . 0.0 112.898 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -60.47 -32.03 71.02 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 171.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -82.37 -37.63 25.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.265 1.426 . . . . 0.0 111.602 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.42 -48.39 81.84 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.641 0.777 . . . . 0.0 112.61 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -68.27 -3.66 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 124.18 0.992 . . . . 0.0 112.618 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -111.99 -4.8 14.41 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 125.627 1.571 . . . . 0.0 114.148 176.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.78 159.44 32.92 Favored 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.78 -1.2 . . . . 0.0 111.389 177.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -54.01 134.02 58.5 Favored Pre-proline 0 N--CA 1.484 1.227 0 C-N-CA 124.81 1.244 . . . . 0.0 113.8 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.48 -15.49 41.8 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.085 2.523 . . . . 0.0 116.223 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.2 mptt -71.08 -55.51 8.08 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 120.759 1.618 . . . . 0.0 109.331 170.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.44 -0.18 48.95 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -175.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.76 -40.42 95.08 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.256 23.2 m -66.94 -50.95 40.36 Favored Pre-proline 0 N--CA 1.481 1.093 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -175.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.1 -42.13 47.02 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.607 2.871 . . . . 0.0 115.538 169.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.2 p -73.64 -40.75 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.432 1.014 . . . . 0.0 113.241 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.75 66.65 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.754 0.822 . . . . 0.0 111.494 174.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.494 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 76.7 t90 -87.97 -50.48 6.39 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.05 -1.452 . . . . 0.0 112.104 168.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.42 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 2.0 t90 -67.62 -26.9 66.47 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 121.685 2.039 . . . . 0.0 112.12 -168.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.41 -43.01 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.663 0.785 . . . . 0.0 111.777 169.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.57 -32.88 62.54 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.812 1.645 . . . . 0.0 111.766 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -136.91 107.54 6.55 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.729 2.011 . . . . 0.0 109.695 167.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -72.51 171.93 11.45 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.82 1.81 1.23 Allowed 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 172.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.5 t -53.14 140.78 24.9 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.751 1.221 . . . . 0.0 111.775 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.37 132.57 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.708 -0.62 . . . . 0.0 110.673 -172.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.53 159.1 34.48 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.99 1.316 . . . . 0.0 113.836 -173.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.5 148.0 35.35 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.636 1.574 . . . . 0.0 112.395 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.36 4.83 65.45 Favored Glycine 0 CA--C 1.543 1.8 0 C-N-CA 124.365 0.983 . . . . 0.0 115.508 -176.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 146.64 -161.45 28.39 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.1 1.809 . . . . 0.0 111.554 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -124.46 -116.17 0.29 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.327 1.051 . . . . 0.0 111.037 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.3 m 63.04 45.06 5.47 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.884 1.274 . . . . 0.0 111.637 -169.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.75 7.78 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 O-C-N 121.2 -0.937 . . . . 0.0 113.483 169.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.64 157.45 1.57 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.849 1.659 . . . . 0.0 112.005 168.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 tp -72.99 77.85 1.18 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 165.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -73.72 170.76 14.61 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.848 1.659 . . . . 0.0 112.937 -168.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.01 -26.23 66.68 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.235 -1.541 . . . . 0.0 113.746 -171.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 86.2 m -70.33 -40.78 73.93 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.432 -0.792 . . . . 0.0 110.395 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -59.97 -42.6 94.48 Favored 'General case' 0 C--O 1.221 -0.442 0 O-C-N 121.15 -0.969 . . . . 0.0 110.348 174.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.02 -21.52 66.54 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 120.969 -1.082 . . . . 0.0 112.207 177.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.4 m -81.48 -37.42 27.95 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.987 0.915 . . . . 0.0 111.438 169.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -83.74 -28.07 28.48 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.776 1.171 . . . . 0.0 113.864 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.27 -42.88 96.22 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 119.985 1.266 . . . . 0.0 112.152 176.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.53 -35.5 10.3 Favored 'Trans proline' 0 C--N 1.353 0.788 0 CA-C-N 122.145 1.802 . . . . 0.0 113.269 169.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -66.1 -36.33 82.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.109 -1.62 . . . . 0.0 113.671 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.12 -20.78 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.798 0.727 . . . . 0.0 112.573 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 39.3 mt -82.34 -50.67 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.062 0.945 . . . . 0.0 110.558 171.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.25 -38.71 77.43 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 123.853 0.861 . . . . 0.0 111.9 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -69.41 -29.09 66.75 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.954 0.502 . . . . 0.0 111.601 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.6 m -77.19 -46.27 23.88 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.922 174.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -29.47 68.41 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.974 1.716 . . . . 0.0 114.159 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -75.64 -29.08 59.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -134.66 74.63 64.67 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.971 1.309 . . . . 0.0 111.871 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -58.37 -12.44 13.56 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.442 3.428 . . . . 0.0 117.445 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -79.63 -23.95 42.25 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.884 1.273 . . . . 0.0 113.401 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt -64.85 154.66 36.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.37 1.068 . . . . 0.0 112.085 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -80.99 151.58 28.39 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.427 -0.796 . . . . 0.0 109.622 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.0 tp -66.33 -36.55 83.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.86 -1.15 . . . . 0.0 113.132 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.45 -20.94 30.93 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -64.27 -14.54 56.47 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.214 -0.929 . . . . 0.0 112.288 169.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -66.78 -3.52 6.95 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 119.156 -2.215 . . . . 0.0 113.906 169.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -32.77 56.18 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.71 1.204 . . . . 0.0 111.199 165.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -65.69 -29.93 70.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.69 1.596 . . . . 0.0 112.279 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -74.24 -29.61 61.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.579 1.552 . . . . 0.0 114.765 174.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.11 105.86 17.82 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.927 1.291 . . . . 0.0 113.767 -167.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.5 p -68.59 -20.67 64.52 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.024 1.33 . . . . 0.0 113.101 169.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -59.85 105.6 0.4 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.942 1.297 . . . . 0.0 108.92 167.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -167.16 -24.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -172.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -154.49 150.99 22.91 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 125.394 1.477 . . . . 0.0 112.696 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -60.96 135.6 60.33 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.752 2.301 . . . . 0.0 111.436 167.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 125.747 1.619 . . . . 0.0 112.644 179.453 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.29 14.5 t-20 65.77 63.54 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.429 1.892 . . . . 0.0 113.378 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -113.29 163.15 15.19 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 128.383 2.673 . . . . 0.0 104.431 165.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 69.5 m -86.43 91.78 8.63 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.808 1.643 . . . . 0.0 113.378 -165.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.91 -35.67 64.39 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 120.385 -1.447 . . . . 0.0 110.789 170.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.464 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 18.2 mtmt -76.5 -4.33 42.09 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.303 2.241 . . . . 0.0 115.942 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -134.72 17.26 3.58 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.719 1.208 . . . . 0.0 112.207 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 58.6 ttm -59.63 134.44 57.02 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 121.292 -0.88 . . . . 0.0 108.711 170.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -72.02 166.94 21.2 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.468 1.128 . . . . 0.0 112.176 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.69 -31.27 68.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.212 170.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -65.45 -38.36 89.61 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.055 0.843 . . . . 0.0 112.397 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -68.76 -41.57 78.7 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 121.459 -0.776 . . . . 0.0 112.094 172.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -59.46 -47.71 84.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.616 0.644 . . . . 0.0 111.947 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -71.27 -13.26 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.676 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.46 -24.42 20.71 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.467 1.031 . . . . 0.0 113.547 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.03 155.47 36.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.38 1.072 . . . . 0.0 112.139 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . 0.48 HD22 ' HD2' ' B' ' 98' ' ' LYS . 36.7 t30 -75.16 139.4 72.45 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -65.58 -16.5 54.0 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 121.918 1.745 . . . . 0.0 116.238 -172.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.48 ' HD2' HD22 ' B' ' 96' ' ' ASN . 6.2 mptt -60.08 -61.11 2.85 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.672 -1.268 . . . . 0.0 110.46 168.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.1 -8.99 57.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -177.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -57.31 -40.66 78.35 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.02 -1.05 . . . . 0.0 110.911 168.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.5 m -57.87 -57.77 23.3 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.39 1.076 . . . . 0.0 113.113 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.78 -40.54 79.73 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 124.12 3.213 . . . . 0.0 115.791 172.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -76.8 -36.56 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 CA-C-N 120.717 1.599 . . . . 0.0 113.355 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.02 -29.48 69.74 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.755 0.822 . . . . 0.0 111.03 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.518 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 67.5 t90 -80.06 -53.05 7.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 117.869 -1.062 . . . . 0.0 112.772 169.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.518 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.17 -30.05 70.44 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 117.909 -1.516 . . . . 0.0 111.305 -168.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -58.56 -34.5 71.12 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.705 0.802 . . . . 0.0 112.896 171.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -78.87 -17.39 55.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.442 1.897 . . . . 0.0 114.468 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . 0.434 ' CG ' HD22 ' B' ' 154' ' ' ASN . 0.2 OUTLIER -131.12 -19.86 2.8 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -173.235 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 63.76 160.25 0.09 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 129.797 3.239 . . . . 0.0 117.443 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -73.46 29.33 0.07 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.155 2.182 . . . . 0.0 114.44 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 t -78.63 177.72 8.39 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.505 1.922 . . . . 0.0 113.509 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 65.9 t -101.29 132.05 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.934 1.694 . . . . 0.0 106.475 168.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -75.85 153.94 36.47 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -167.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -145.62 155.9 43.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.501 1.521 . . . . 0.0 112.836 -169.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.01 -106.53 1.95 Allowed Glycine 0 CA--C 1.534 1.265 0 C-N-CA 123.763 0.697 . . . . 0.0 111.82 -174.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.99 -155.13 7.52 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.621 1.105 . . . . 0.0 113.547 172.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -122.03 22.26 10.33 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.196 1.399 . . . . 0.0 112.537 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 11.4 p -75.0 42.13 0.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.853 2.061 . . . . 0.0 115.353 -170.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 34.6 m -65.37 -17.67 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.499 1.12 . . . . 0.0 111.263 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.46 155.71 5.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.609 2.364 . . . . 0.0 112.163 167.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 52.3 mt -65.21 121.94 15.94 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.62 -0.675 . . . . 0.0 110.179 168.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -90.87 161.1 15.38 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.128 1.371 . . . . 0.0 109.697 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -64.12 -26.25 68.45 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.31 -1.494 . . . . 0.0 112.29 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 35.4 m -63.99 -41.44 97.52 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.517 -0.739 . . . . 0.0 111.457 169.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -62.77 -50.94 69.06 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.574 1.079 . . . . 0.0 110.129 174.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.2 mt -56.83 -31.53 64.83 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.812 0.845 . . . . 0.0 112.544 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 38.1 m -80.71 -35.98 32.82 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.928 0.891 . . . . 0.0 112.144 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -81.73 -30.01 32.66 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.93 -40.51 72.4 Favored Pre-proline 0 CA--C 1.555 1.148 0 CA-C-N 120.525 1.511 . . . . 0.0 113.723 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -74.05 -37.46 2.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 CA-C-N 122.067 1.774 . . . . 0.0 113.632 169.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -67.68 -30.27 69.75 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 120.372 -1.455 . . . . 0.0 114.181 -174.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -67.64 -24.22 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.584 . . . . 0.0 112.379 173.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 48.9 mt -72.87 -53.16 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.209 1.004 . . . . 0.0 109.734 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -55.26 -53.74 52.24 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.469 0.707 . . . . 0.0 110.967 176.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.81 -24.96 67.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.191 -0.943 . . . . 0.0 112.816 -177.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -78.82 -47.62 16.31 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.648 1.113 . . . . 0.0 112.314 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -25.28 67.94 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 120.93 1.695 . . . . 0.0 113.463 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -74.81 -26.85 60.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.455 1.502 . . . . 0.0 114.959 169.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -135.85 62.49 47.39 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.331 1.453 . . . . 0.0 110.871 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.47 -16.0 39.42 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.577 2.851 . . . . 0.0 114.773 -171.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -78.39 -23.88 46.58 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.973 1.709 . . . . 0.0 114.283 -177.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -67.1 164.42 18.0 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.27 1.428 . . . . 0.0 112.901 -173.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.37 131.04 37.12 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 168.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.6 tp -46.03 -37.99 7.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.739 1.616 . . . . 0.0 113.728 179.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.464 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 7.2 m-85 -78.31 -8.64 58.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.0 p -65.44 -24.3 67.15 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 120.786 -1.197 . . . . 0.0 111.636 168.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -72.97 -2.48 21.18 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -80.04 -32.11 39.51 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.663 1.12 . . . . 0.0 111.632 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -68.33 -30.85 69.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.744 0.818 . . . . 0.0 112.078 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -73.34 -28.56 62.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.258 1.823 . . . . 0.0 115.253 169.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -133.69 80.1 1.85 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.189 1.395 . . . . 0.0 114.021 -165.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 45.8 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.966 168.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . 0.434 HD22 ' CG ' ' B' ' 109' ' ' HIS . 35.0 p-10 -70.15 -54.18 14.03 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 -168.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -161.68 -34.65 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.72 1.608 . . . . 0.0 114.429 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -65.11 147.81 98.29 Favored Pre-proline 0 CA--C 1.552 1.057 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -170.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.0 151.5 71.61 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.293 2.662 . . . . 0.0 114.091 175.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 125.816 1.646 . . . . 0.0 113.191 178.084 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.979 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.0 t30 57.23 46.68 18.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.932 1.693 . . . . 0.0 114.428 179.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.406 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 19.8 mm-40 -58.45 -26.36 63.25 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.201 167.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 t 100.24 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.261 3.024 . . . . 0.0 115.138 169.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.79 -26.28 68.56 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.073 -1.642 . . . . 0.0 111.01 169.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HD3' ' CE1' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -67.15 -20.26 65.72 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.961 2.104 . . . . 0.0 113.782 175.452 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -115.58 5.2 14.31 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.937 1.295 . . . . 0.0 113.29 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.1 ttm -62.62 123.24 17.84 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.017 -1.052 . . . . 0.0 109.977 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -79.17 155.4 28.67 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.227 -0.921 . . . . 0.0 110.695 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.11 -34.97 75.8 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.604 -1.31 . . . . 0.0 112.831 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -61.62 -33.38 73.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.95 0.796 . . . . 0.0 112.95 172.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -78.63 -37.36 42.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.994 1.318 . . . . 0.0 111.607 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.81 -49.64 76.91 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.613 0.765 . . . . 0.0 112.409 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.6 pt -68.38 -5.87 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.324 1.05 . . . . 0.0 112.896 177.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -105.16 -8.84 18.13 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.412 1.485 . . . . 0.0 113.494 174.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.36 159.87 31.8 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 120.957 -1.089 . . . . 0.0 111.203 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -67.64 130.08 93.23 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.039 -1.038 . . . . 0.0 112.187 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.79 -16.99 12.48 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.809 3.673 . . . . 0.0 116.396 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -64.4 -67.62 0.42 Allowed 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.813 2.045 . . . . 0.0 108.649 166.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.84 -10.45 59.51 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.38 -34.91 73.0 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.272 19.1 m -66.3 -52.65 36.24 Favored Pre-proline 0 N--CA 1.481 1.081 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -50.98 -43.95 44.81 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.368 2.712 . . . . 0.0 115.469 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.3 p -73.04 -38.45 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-N 119.218 0.917 . . . . 0.0 113.095 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.21 -20.51 66.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.254 1.022 . . . . 0.0 111.783 174.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.474 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 58.4 t90 -88.65 -51.2 5.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.81 168.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.426 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 1.9 t90 -69.2 -31.08 69.44 Favored 'General case' 0 C--N 1.351 0.63 0 CA-C-N 120.025 1.284 . . . . 0.0 112.252 -168.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -63.92 -43.84 94.7 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.625 0.77 . . . . 0.0 110.995 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -71.23 -34.39 70.75 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.592 1.157 . . . . 0.0 112.802 -173.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -97.3 -2.31 42.84 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.417 ' HG2' ' H ' ' A' ' 32' ' ' GLU . 7.8 tt0 61.69 173.32 0.12 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.825 1.65 . . . . 0.0 112.989 -168.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 31' ' ' GLU . 45.7 mt-10 -76.37 48.48 0.53 Allowed 'General case' 0 N--CA 1.478 0.957 0 O-C-N 120.518 -1.364 . . . . 0.0 112.991 -175.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.5 t -148.48 173.94 12.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.553 1.941 . . . . 0.0 112.074 -173.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.8 t -125.01 155.04 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.591 1.956 . . . . 0.0 107.82 169.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.58 160.1 11.97 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -81.39 4.37 21.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.081 1.352 . . . . 0.0 114.558 -169.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 178.6 -36.72 0.08 OUTLIER Glycine 0 CA--C 1.539 1.542 0 C-N-CA 125.127 1.346 . . . . 0.0 113.755 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -71.28 169.82 48.87 Favored Glycine 0 CA--C 1.54 1.634 0 CA-C-N 117.887 0.843 . . . . 0.0 113.4 169.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -142.06 -0.21 1.32 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 -172.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -77.94 54.79 1.34 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.221 1.408 . . . . 0.0 112.371 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.9 m -61.47 -11.74 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 125.555 1.542 . . . . 0.0 113.068 172.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -39.78 141.25 0.44 Allowed 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.59 2.356 . . . . 0.0 111.759 168.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 30.4 mt -70.07 76.39 0.5 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.881 0.848 . . . . 0.0 109.913 168.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -69.41 175.61 3.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.737 2.015 . . . . 0.0 112.411 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.65 -23.03 64.37 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.742 -1.849 . . . . 0.0 113.771 -172.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.3 m -71.1 -42.0 69.86 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.255 0.934 . . . . 0.0 110.483 169.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.9 -49.1 77.89 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.548 -0.72 . . . . 0.0 111.795 170.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.07 -22.3 66.94 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.129 -0.982 . . . . 0.0 111.812 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.9 m -79.17 -36.87 39.66 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.172 0.989 . . . . 0.0 111.67 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -82.65 -33.59 27.74 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.551 -1.343 . . . . 0.0 113.876 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.43 -42.38 87.28 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.696 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.41 -37.93 7.0 Favored 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 122.119 1.793 . . . . 0.0 113.385 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -67.02 -34.45 77.75 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.149 -1.594 . . . . 0.0 113.68 -176.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.6 m -67.52 -16.2 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 173.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.7 mt -90.58 -50.73 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.221 1.408 . . . . 0.0 110.687 172.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.28 -39.14 78.46 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.309 1.043 . . . . 0.0 111.482 177.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -70.14 -24.29 63.15 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.14 -0.975 . . . . 0.0 111.52 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.82 -44.8 17.91 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.999 0.92 . . . . 0.0 112.031 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -27.69 69.37 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 120.666 1.575 . . . . 0.0 113.526 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -69.56 -35.12 75.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 168.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -130.04 65.78 76.21 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.682 1.193 . . . . 0.0 112.263 -178.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -55.71 -14.43 10.43 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.53 2.82 . . . . 0.0 117.033 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -84.85 -21.41 29.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.375 1.47 . . . . 0.0 113.65 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -70.07 158.32 35.92 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.327 1.051 . . . . 0.0 111.981 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -94.91 133.37 38.72 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.4 tp -49.64 -42.81 46.07 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -168.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.438 ' CE1' ' HD3' ' A' ' 6' ' ' LYS . 7.5 m-85 -75.0 -8.56 56.86 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -178.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 69.0 p -60.41 -27.37 67.4 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.349 -1.47 . . . . 0.0 111.517 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -72.87 -3.85 28.22 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.76 1.224 . . . . 0.0 113.7 177.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -79.73 -30.95 41.05 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.338 0.972 . . . . 0.0 111.747 168.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -69.71 -26.03 64.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.72 1.208 . . . . 0.0 112.243 -170.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -76.88 -31.82 57.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.843 1.657 . . . . 0.0 114.872 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -97.81 110.66 23.19 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.304 1.042 . . . . 0.0 113.658 -167.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -133.26 106.94 7.84 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.709 1.203 . . . . 0.0 110.913 170.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -143.47 -52.07 0.35 Allowed 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.99 -4.66 57.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -166.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -143.76 150.02 48.69 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 124.981 1.312 . . . . 0.0 113.634 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.98 161.65 45.37 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.233 2.622 . . . . 0.0 112.152 170.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 . . . . . 0 C--O 1.249 1.055 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 174.873 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.982 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 49.1 t30 57.86 50.14 10.93 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.795 1.638 . . . . 0.0 114.226 177.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -63.39 -16.87 61.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 0.0 113.139 168.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.1 t 101.62 95.09 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.68 3.192 . . . . 0.0 116.305 168.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.22 -37.39 77.38 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.339 -1.476 . . . . 0.0 112.202 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.3 ptpt -76.01 -13.22 60.23 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -107.92 7.26 27.91 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.656 1.183 . . . . 0.0 113.051 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 40.5 ttm -62.55 128.66 37.02 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.795 -1.19 . . . . 0.0 109.829 173.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -77.17 154.55 33.04 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 120.929 -1.107 . . . . 0.0 110.744 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.16 -33.67 74.95 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.225 -1.547 . . . . 0.0 113.277 -174.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -30.79 71.15 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 119.171 0.896 . . . . 0.0 112.22 173.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -76.54 -37.23 56.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.677 1.191 . . . . 0.0 111.504 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.25 -49.63 76.33 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.418 -0.801 . . . . 0.0 113.022 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 9.0 pt -66.61 -8.86 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -102.08 -12.14 18.33 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.114 1.766 . . . . 0.0 114.015 173.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.51 157.73 37.35 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.616 1.098 . . . . 0.0 111.45 176.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -57.51 134.66 82.06 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.421 1.088 . . . . 0.0 113.458 178.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -75.92 -6.32 17.3 Favored 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 121.483 1.456 . . . . 0.0 115.176 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.406 ' HG3' ' C ' ' A' ' 3' ' ' GLU . 6.3 mptt -70.04 -55.28 9.94 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.454 1.479 . . . . 0.0 109.207 168.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.72 -9.61 55.53 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -178.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.2 ttm -56.06 -30.91 62.64 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 120.243 -1.536 . . . . 0.0 112.731 169.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.7 m -66.05 -57.2 13.96 Favored Pre-proline 0 N--CA 1.482 1.153 0 CA-C-O 117.813 -1.089 . . . . 0.0 112.603 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.43 -36.43 79.41 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.916 3.077 . . . . 0.0 114.113 169.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.06 -53.29 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 119.275 0.943 . . . . 0.0 111.196 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.16 75.22 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.235 1.014 . . . . 0.0 111.257 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.491 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.9 t90 -69.37 -53.68 18.29 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 117.649 -1.167 . . . . 0.0 112.22 169.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.491 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.6 t90 -65.09 -32.35 74.02 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.03 -1.468 . . . . 0.0 111.998 -167.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 62.8 ttp -53.63 -46.03 70.36 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.544 1.137 . . . . 0.0 111.893 169.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -76.19 -21.54 56.37 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.015 1.326 . . . . 0.0 113.841 -178.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -149.05 81.41 1.43 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.417 1.087 . . . . 0.0 110.969 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.79 161.14 29.12 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 117.044 2.238 . . . . 0.0 117.044 -167.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.44 17.92 0.25 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 115.491 1.663 . . . . 0.0 115.491 172.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 40.4 p -73.67 38.26 0.1 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.341 1.857 . . . . 0.0 113.994 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . 0.267 46.0 t 65.01 133.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.971 3.709 . . . . 0.0 113.348 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -81.54 60.67 4.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -166.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt -63.06 -10.5 14.54 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.792 2.037 . . . . 0.0 115.985 -173.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -70.01 -14.17 70.49 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 124.719 1.152 . . . . 0.0 115.127 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 79.88 64.23 1.9 Allowed Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.846 1.323 . . . . 0.0 113.139 176.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.351 4.7 p-10 48.44 38.62 11.14 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 174.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 27.5 p -64.49 -30.38 71.41 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.008 -1.058 . . . . 0.0 111.53 166.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 83.9 t 63.73 127.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 130.776 3.63 . . . . 0.0 117.208 172.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . 0.255 1.2 t 54.35 -177.38 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.767 2.827 . . . . 0.0 117.708 167.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 2.3 pp -67.42 166.46 14.54 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 128.417 2.687 . . . . 0.0 114.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -133.95 -178.82 5.2 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.817 2.047 . . . . 0.0 111.44 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.14 -24.38 67.39 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.637 -1.289 . . . . 0.0 114.021 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 52.2 m -65.57 -38.69 90.28 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.265 -0.897 . . . . 0.0 111.062 169.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -66.2 -44.14 84.74 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.836 1.198 . . . . 0.0 110.655 175.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.4 mt -57.07 -26.29 60.15 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.3 m -83.54 -32.41 25.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.918 1.287 . . . . 0.0 112.597 173.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -78.71 -34.51 45.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.775 -1.203 . . . . 0.0 113.447 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.49 -38.26 60.04 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 117.379 -1.296 . . . . 0.0 113.474 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -75.6 -37.55 1.7 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 CA-C-N 122.246 1.838 . . . . 0.0 113.18 168.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -64.02 -33.52 75.93 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.593 -1.317 . . . . 0.0 113.766 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.53 -26.4 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.575 0.75 . . . . 0.0 112.789 178.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 52.3 mt -69.42 -50.1 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.632 0.773 . . . . 0.0 109.323 171.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.4 -42.49 91.9 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.055 0.942 . . . . 0.0 111.878 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.57 -25.7 65.03 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.735 -1.228 . . . . 0.0 112.117 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.54 -45.38 25.58 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.288 -0.883 . . . . 0.0 111.829 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -27.29 68.77 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.459 1.481 . . . . 0.0 113.652 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -71.11 -36.04 72.0 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 168.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -127.51 62.62 55.61 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.234 1.414 . . . . 0.0 110.727 -176.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.83 -13.63 27.8 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.521 2.814 . . . . 0.0 114.786 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -81.69 -23.66 36.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.132 1.773 . . . . 0.0 114.304 -178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -66.26 156.93 32.86 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.84 1.256 . . . . 0.0 112.072 -175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -89.57 131.78 35.41 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.1 tp -48.17 -52.35 21.11 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -168.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.88 -8.03 40.2 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -174.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 72.6 p -57.59 -27.29 62.59 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 120.539 -1.351 . . . . 0.0 111.118 168.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -71.22 -3.86 22.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.469 1.508 . . . . 0.0 114.48 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -34.55 40.6 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.772 1.169 . . . . 0.0 111.655 167.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.75 -31.41 66.63 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.018 1.327 . . . . 0.0 112.392 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -66.06 -30.31 70.81 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.306 1.442 . . . . 0.0 114.456 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.47 -59.44 1.7 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -167.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m 32.34 56.14 0.37 Allowed 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 126.609 1.963 . . . . 0.0 114.73 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -69.26 -23.06 63.81 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -173.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -142.97 179.01 7.28 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.389 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . 0.313 0.4 OUTLIER 55.91 150.56 0.05 OUTLIER Pre-proline 0 CA--C 1.56 1.331 0 C-N-CA 130.931 3.692 . . . . 0.0 116.505 -169.177 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.78 155.14 50.66 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.231 2.62 . . . . 0.0 114.101 173.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.94 1.696 . . . . 0.0 112.802 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.05 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.348 9.1 t-20 69.97 30.17 3.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.126 1.899 . . . . 0.0 116.126 174.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.86 160.53 32.01 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 105.12 -2.178 . . . . 0.0 105.12 160.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 t -104.73 116.1 31.45 Favored 'General case' 0 CA--C 1.505 -0.756 0 O-C-N 120.585 -1.322 . . . . 0.0 112.313 -166.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.14 -32.82 73.36 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.091 167.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.43 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.4 mtmt -63.24 -28.96 70.39 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.504 1.922 . . . . 0.0 114.209 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -113.59 10.44 18.07 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.236 1.414 . . . . 0.0 112.647 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 12.7 ttm -64.29 123.43 19.12 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.726 -1.234 . . . . 0.0 108.616 170.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.8 t -79.36 157.85 27.55 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.117 -0.989 . . . . 0.0 110.695 -174.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.53 -35.6 78.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.587 -1.32 . . . . 0.0 112.84 -174.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -61.24 -33.44 73.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -79.9 -38.48 32.47 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.12 1.368 . . . . 0.0 111.67 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -59.19 -49.65 77.04 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.991 0.917 . . . . 0.0 112.705 176.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -67.71 -5.15 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 C-N-CA 124.362 1.065 . . . . 0.0 112.641 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -107.26 -6.83 17.01 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.325 1.45 . . . . 0.0 113.707 173.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.02 160.82 29.44 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.915 -1.115 . . . . 0.0 110.94 175.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.9 t-20 -64.78 131.08 95.05 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 121.157 -0.964 . . . . 0.0 111.999 -176.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -60.61 -16.53 43.54 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.437 2.758 . . . . 0.0 114.969 -178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -60.27 -67.39 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.717 1.607 . . . . 0.0 110.161 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.12 -3.74 53.02 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 ttt -57.71 -40.46 79.57 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 169.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -64.83 -54.18 37.35 Favored Pre-proline 0 N--CA 1.481 1.125 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -48.97 -44.41 32.52 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.732 2.955 . . . . 0.0 115.886 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.1 p -72.5 -42.25 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.28 -35.69 70.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.877 0.471 . . . . 0.0 110.229 171.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 75.1 t90 -76.3 -49.84 15.9 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.587 177.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.422 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 1.4 t90 -64.75 -25.33 67.88 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 120.383 1.447 . . . . 0.0 111.264 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -66.92 -50.71 61.52 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.422 1.489 . . . . 0.0 111.693 168.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -37.57 87.72 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.543 1.137 . . . . 0.0 113.765 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -121.53 96.7 5.18 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.844 1.658 . . . . 0.0 109.164 174.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.95 149.84 35.24 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -177.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -76.34 -3.54 37.34 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.589 1.956 . . . . 0.0 114.115 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.5 p -74.16 25.72 0.08 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.524 1.93 . . . . 0.0 115.624 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 57.7 t 59.35 133.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 128.875 2.87 . . . . 0.0 115.018 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -76.55 158.29 31.32 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.7 -1.25 . . . . 0.0 113.171 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -142.64 49.58 1.49 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.582 1.553 . . . . 0.0 112.067 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.43 -8.62 0.04 OUTLIER Glycine 0 CA--C 1.542 1.738 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.85 -173.69 40.2 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.447 1.623 . . . . 0.0 114.332 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -113.87 47.43 1.19 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.886 2.474 . . . . 0.0 110.658 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.88 24.23 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 128.8 2.84 . . . . 0.0 117.166 -168.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.21 -21.44 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 O-C-N 120.367 -1.458 . . . . 0.0 112.086 170.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 12.6 p -56.32 141.64 40.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.817 1.647 . . . . 0.0 112.826 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.9 mt -92.54 150.31 20.83 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.119 0.568 . . . . 0.0 110.263 169.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -145.43 170.78 15.68 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.801 1.241 . . . . 0.0 111.527 -173.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.22 -27.27 67.1 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.837 -1.164 . . . . 0.0 113.489 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.3 m -63.62 -51.99 62.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.967 0.803 . . . . 0.0 110.133 169.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.83 -49.55 70.77 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.354 0.525 . . . . 0.0 110.365 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.0 mt -61.22 -33.61 73.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.892 0.877 . . . . 0.0 112.412 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.2 m -72.9 -35.91 67.19 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.424 1.09 . . . . 0.0 111.404 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm100 -78.52 -24.06 45.94 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.759 -1.115 . . . . 0.0 113.134 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.95 -47.93 95.45 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 120.352 1.433 . . . . 0.0 112.399 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.48 -34.1 21.09 Favored 'Trans proline' 0 C--N 1.354 0.864 0 CA-C-N 121.865 1.702 . . . . 0.0 113.342 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -67.58 -34.33 76.82 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.502 1.501 . . . . 0.0 114.057 -177.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.13 -20.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.77 0.714 . . . . 0.0 112.79 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.83 -50.37 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.501 1.121 . . . . 0.0 110.781 171.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.56 -39.07 79.25 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.9 0.88 . . . . 0.0 111.783 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -69.23 -28.81 66.68 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.434 0.561 . . . . 0.0 111.627 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.7 m -77.68 -46.72 21.1 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.293 -0.88 . . . . 0.0 112.921 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -28.96 67.55 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.85 1.659 . . . . 0.0 114.334 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -75.0 -30.23 61.08 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 173.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -134.13 75.4 65.88 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.098 1.359 . . . . 0.0 112.137 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -59.27 -9.59 8.79 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.405 3.403 . . . . 0.0 117.297 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -81.9 -21.68 37.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.351 1.46 . . . . 0.0 113.129 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -68.76 160.35 30.58 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.809 1.244 . . . . 0.0 111.387 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -83.7 152.04 24.94 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.619 -0.676 . . . . 0.0 110.759 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.9 tp -67.5 -35.4 79.06 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.08 -1.012 . . . . 0.0 113.357 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.43 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -90.91 -23.85 20.37 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -58.83 -23.6 60.8 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.366 -0.834 . . . . 0.0 111.675 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -61.46 -4.77 1.41 Allowed 'General case' 0 CA--C 1.539 0.548 0 O-C-N 119.692 -1.88 . . . . 0.0 113.696 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -35.17 67.05 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 120.957 -1.089 . . . . 0.0 111.945 167.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.77 -30.51 71.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.916 0.886 . . . . 0.0 113.249 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -73.56 -23.14 59.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.729 1.612 . . . . 0.0 114.395 173.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.1 14.95 18.38 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.0 2.12 . . . . 0.0 116.015 -166.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 57.9 m -66.77 81.01 0.11 Allowed 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -176.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -123.86 -1.39 8.38 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 127.399 2.28 . . . . 0.0 113.002 169.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -71.97 -41.97 67.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 128.222 2.609 . . . . 0.0 111.998 170.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -150.52 151.84 31.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.421 1.889 . . . . 0.0 112.336 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -72.01 157.93 53.5 Favored 'Trans proline' 0 N--CA 1.44 -1.654 0 C-N-CA 122.633 2.222 . . . . 0.0 110.668 167.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 27.7 m120 . . . . . 0 C--O 1.276 2.487 0 C-N-CA 125.624 1.569 . . . . 0.0 108.26 173.332 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.154 0 CA-C-O 120.892 0.377 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.266 0.6 OUTLIER 67.72 54.12 0.66 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 123.22 1.486 . . . . 0.0 113.029 173.201 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -97.5 157.63 15.91 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 103.795 -2.668 . . . . 0.0 103.795 165.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.2 m -86.44 86.52 7.34 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 125.019 1.328 . . . . 0.0 113.416 -164.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.31 53.53 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.084 1.311 . . . . 0.0 111.033 171.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.408 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 9.4 ptpt -77.67 -0.51 26.96 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.958 2.103 . . . . 0.0 116.411 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -136.45 19.07 3.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.979 1.312 . . . . 0.0 112.233 170.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.4 ttm -60.75 123.22 16.86 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.899 -1.126 . . . . 0.0 108.192 169.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.76 153.87 32.49 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.577 -0.702 . . . . 0.0 109.963 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -61.51 -33.48 73.88 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.805 -1.185 . . . . 0.0 112.991 -173.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -65.94 -30.99 71.66 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.024 0.829 . . . . 0.0 112.975 173.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -77.33 -37.89 51.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.976 1.311 . . . . 0.0 111.101 173.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -62.78 -48.98 76.78 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.446 -0.784 . . . . 0.0 112.702 177.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.6 pt -69.21 -4.11 3.44 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 123.597 0.759 . . . . 0.0 112.977 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.8 -12.62 16.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.145 1.778 . . . . 0.0 114.124 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 159.78 32.87 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 119.763 1.165 . . . . 0.0 110.849 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -66.66 129.09 94.11 Favored Pre-proline 0 N--CA 1.483 1.206 0 O-C-N 121.384 -0.822 . . . . 0.0 111.165 -177.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.77 -18.17 47.19 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.927 2.418 . . . . 0.0 114.786 179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 32.1 mttp -56.14 -66.76 0.38 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.184 1.793 . . . . 0.0 109.495 168.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.5 -7.22 59.55 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 17.3 ttm -56.82 -43.27 80.86 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.958 -1.089 . . . . 0.0 111.544 169.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 60.3 m -55.61 -57.48 20.88 Favored Pre-proline 0 N--CA 1.484 1.228 0 CA-C-O 118.036 -0.983 . . . . 0.0 113.551 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -52.93 -43.39 57.06 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.21 3.273 . . . . 0.0 115.621 172.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.2 p -73.92 -39.24 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 120.235 1.38 . . . . 0.0 113.263 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.29 -29.89 69.12 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.086 0.954 . . . . 0.0 111.061 172.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.51 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 61.1 t90 -79.37 -53.49 6.87 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.353 169.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.51 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.5 t90 -64.55 -29.9 70.93 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 120.903 1.683 . . . . 0.0 112.65 -167.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -61.36 -51.28 69.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.355 1.062 . . . . 0.0 111.415 171.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -27.98 65.95 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.671 1.588 . . . . 0.0 111.666 -178.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . 0.491 ' CG ' HD21 ' B' ' 154' ' ' ASN . 14.6 t60 -148.24 96.19 2.58 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.504 1.122 . . . . 0.0 111.72 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.0 166.62 21.84 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -171.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 1.19 1.21 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.776 1.63 . . . . 0.0 115.378 171.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 13.5 t -58.64 144.23 43.88 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.085 -1.009 . . . . 0.0 111.845 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 79.6 t -66.03 131.86 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 O-C-N 121.65 -0.656 . . . . 0.0 111.513 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -67.74 167.05 14.03 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.989 1.316 . . . . 0.0 113.358 -176.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.0 -0.84 23.06 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 155.52 -23.42 0.57 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.139 1.352 . . . . 0.0 114.618 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.71 168.41 54.27 Favored Glycine 0 CA--C 1.538 1.51 0 CA-C-N 118.211 1.006 . . . . 0.0 115.08 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.9 p30 -128.15 13.16 6.68 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.654 1.982 . . . . 0.0 113.113 174.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 7.0 p -80.37 61.14 4.03 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 127.108 2.163 . . . . 0.0 112.255 -172.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.79 10.91 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -176.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.0 t -76.7 174.11 10.83 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.252 0.621 . . . . 0.0 109.421 166.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 79.5 mt -86.95 125.09 33.82 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.011 -1.055 . . . . 0.0 112.542 -178.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -79.2 166.06 22.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.617 1.167 . . . . 0.0 110.546 169.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.79 -23.3 62.36 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.884 -1.135 . . . . 0.0 113.741 -173.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 98.1 m -65.02 -51.3 62.38 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.024 0.829 . . . . 0.0 110.396 169.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -54.36 -55.52 27.75 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 118.913 0.778 . . . . 0.0 110.489 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.7 mt -54.27 -36.75 63.96 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 33.9 m -77.38 -35.03 54.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.166 0.586 . . . . 0.0 111.852 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -79.44 -23.61 43.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 117.57 -1.205 . . . . 0.0 114.071 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mm -53.09 -47.21 96.61 Favored Pre-proline 0 N--CA 1.483 1.182 0 CA-C-N 120.757 1.617 . . . . 0.0 112.406 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.53 -32.0 12.8 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.663 1.575 . . . . 0.0 113.759 172.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.47 -35.68 80.87 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.877 -1.139 . . . . 0.0 113.171 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.8 m -69.33 -26.39 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.476 0.58 . . . . 0.0 112.341 174.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.08 -51.1 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.334 0.654 . . . . 0.0 110.334 172.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -52.49 -47.86 66.29 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.841 0.856 . . . . 0.0 112.075 173.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -69.5 -23.37 63.61 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.175 -0.953 . . . . 0.0 112.311 -175.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -78.43 -48.23 15.87 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.277 -0.89 . . . . 0.0 112.049 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -27.25 69.04 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.929 1.241 . . . . 0.0 113.646 174.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -70.94 -33.54 70.6 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -128.22 63.19 62.0 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.171 1.388 . . . . 0.0 111.029 -176.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.2 -14.77 20.78 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.142 3.228 . . . . 0.0 116.608 -169.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -89.41 -18.23 27.22 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 -178.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -66.45 158.96 28.16 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.573 1.149 . . . . 0.0 112.033 -176.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.02 130.75 34.88 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 62.2 tp -46.14 -37.03 6.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 114.027 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.408 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.5 m-85 -78.76 -9.78 59.55 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.7 p -64.77 -24.28 67.51 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 120.603 -1.311 . . . . 0.0 111.671 168.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -73.41 -3.72 29.13 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -78.89 -35.03 44.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.922 1.289 . . . . 0.0 111.558 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -68.34 -32.17 72.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.6 1.16 . . . . 0.0 112.39 -169.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -70.12 -29.24 66.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 115.007 173.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -108.38 -38.52 5.69 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 37.8 m 60.3 -34.88 0.08 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 127.452 2.301 . . . . 0.0 117.085 -170.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . 0.491 HD21 ' CG ' ' B' ' 109' ' ' HIS . 47.0 t30 65.88 162.35 0.15 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.683 2.793 . . . . 0.0 115.44 -174.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.19 133.76 47.39 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.46 1.104 . . . . 0.0 111.736 171.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 24.3 mt -117.3 115.99 37.63 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.855 1.262 . . . . 0.0 109.765 -177.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -84.07 137.74 7.52 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.493 2.129 . . . . 0.0 113.6 -169.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 . . . . . 0 C--O 1.251 1.172 0 C-N-CA 127.311 2.244 . . . . 0.0 111.637 178.734 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.939 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.5 t30 55.73 52.67 10.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.865 1.666 . . . . 0.0 114.27 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -64.61 -17.17 63.75 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 117.855 -1.069 . . . . 0.0 112.654 167.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.5 m 99.24 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 129.645 3.178 . . . . 0.0 115.768 167.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.15 -35.92 72.23 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.997 -1.689 . . . . 0.0 112.339 175.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.491 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -73.13 1.59 8.86 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 173.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -126.22 6.6 7.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.118 1.367 . . . . 0.0 112.126 168.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 35.2 ttm -61.61 126.92 29.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.752 -1.217 . . . . 0.0 109.725 172.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.4 t -78.53 154.14 30.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.0 -33.08 74.65 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.8 -1.188 . . . . 0.0 113.132 -174.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -61.88 -32.15 72.49 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -78.62 -38.26 40.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.635 1.174 . . . . 0.0 111.605 175.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -58.13 -50.32 73.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.1 pt -67.5 -7.96 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.48 1.112 . . . . 0.0 113.178 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -105.0 -8.58 18.45 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 125.812 1.645 . . . . 0.0 113.615 175.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.34 159.4 33.4 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 121.065 -1.022 . . . . 0.0 110.738 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -75.93 137.29 69.52 Favored Pre-proline 0 N--CA 1.483 1.199 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -168.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.56 -14.27 41.55 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.159 2.573 . . . . 0.0 116.486 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -63.31 -61.3 2.44 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 125.449 1.5 . . . . 0.0 108.589 166.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.93 -10.19 59.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -176.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.8 ttt -58.63 -35.08 71.92 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.4 m -64.73 -54.56 35.03 Favored Pre-proline 0 N--CA 1.483 1.182 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -176.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -54.71 -36.85 91.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.902 2.401 . . . . 0.0 115.739 173.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -38.45 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 119.492 1.042 . . . . 0.0 113.549 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -26.41 67.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.876 0.87 . . . . 0.0 111.151 173.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.517 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 70.7 t90 -87.28 -52.4 5.42 Favored 'General case' 0 C--N 1.343 0.304 0 CA-C-O 117.443 -1.265 . . . . 0.0 112.887 169.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.517 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.5 t90 -67.64 -24.72 65.48 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 121.297 1.862 . . . . 0.0 112.25 -167.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -63.85 -50.16 69.97 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.215 1.006 . . . . 0.0 111.349 169.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.45 -22.34 65.5 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.216 1.406 . . . . 0.0 111.852 -176.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -93.02 -36.53 12.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.224 1.81 . . . . 0.0 113.53 173.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.252 30.5 tt0 53.0 61.65 3.08 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 129.213 3.005 . . . . 0.0 114.621 -176.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . 0.257 13.6 pt-20 46.41 17.49 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 117.975 2.583 . . . . 0.0 117.975 168.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 t -74.9 168.43 19.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.721 1.209 . . . . 0.0 112.578 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.67 132.14 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 C-N-CA 124.554 1.142 . . . . 0.0 110.595 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.99 139.09 30.99 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 125.077 1.351 . . . . 0.0 111.417 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.9 ptpt -145.91 149.13 33.65 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.701 1.201 . . . . 0.0 112.138 -169.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.73 -71.95 0.68 Allowed Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.939 1.257 . . . . 0.0 113.188 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.88 169.75 54.35 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.891 1.234 . . . . 0.0 113.893 174.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -121.56 13.85 10.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.065 1.746 . . . . 0.0 113.788 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.5 p -73.13 24.31 0.06 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.689 2.107 . . . . 0.0 116.689 -169.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -66.94 -0.81 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.76 1.224 . . . . 0.0 112.313 166.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . 0.262 17.1 p -57.59 -23.01 48.49 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 128.625 2.77 . . . . 0.0 114.683 167.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.7 mp 72.72 84.55 0.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 128.931 2.893 . . . . 0.0 109.0 -164.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -66.42 172.89 3.64 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.888 169.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -18.56 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 120.626 -1.296 . . . . 0.0 114.019 -170.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 96.7 m -65.21 -45.26 85.47 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.986 1.266 . . . . 0.0 110.929 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.0 -47.83 83.02 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.7 0.682 . . . . 0.0 110.807 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 54.7 mt -66.04 -28.99 69.27 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.551 -0.718 . . . . 0.0 112.025 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.1 m -74.73 -38.53 62.25 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.795 0.838 . . . . 0.0 111.373 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -79.39 -31.16 42.73 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 117.53 -1.224 . . . . 0.0 113.555 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.5 mp -51.23 -42.16 79.47 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 120.79 1.632 . . . . 0.0 113.305 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -71.76 -38.37 4.3 Favored 'Trans proline' 0 C--N 1.352 0.763 0 CA-C-N 122.138 1.799 . . . . 0.0 113.574 169.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mmtt -67.19 -33.41 75.33 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.084 -1.635 . . . . 0.0 113.801 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.3 m -68.2 -18.5 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.1 mt -87.68 -50.44 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.632 1.173 . . . . 0.0 110.268 172.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -58.56 -36.83 74.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.091 0.957 . . . . 0.0 111.934 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -70.85 -28.72 64.8 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.604 0.638 . . . . 0.0 111.882 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -77.11 -41.52 41.73 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.982 -1.073 . . . . 0.0 112.658 176.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -29.2 67.5 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 120.71 1.595 . . . . 0.0 113.973 177.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.417 ' HG3' HD21 ' A' ' 61' ' ' ASN . 14.0 ptpt -81.48 -27.5 34.54 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.417 HD21 ' HG3' ' A' ' 60' ' ' LYS . 17.8 m-80 -130.8 70.84 82.58 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.625 1.57 . . . . 0.0 110.754 173.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.92 -11.99 13.85 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 124.858 3.705 . . . . 0.0 116.368 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -84.63 -21.45 30.28 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.359 1.464 . . . . 0.0 113.292 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -67.9 156.34 37.41 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.669 0.787 . . . . 0.0 111.996 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -89.06 131.72 35.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.4 -38.42 28.85 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -169.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.491 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.26 5.4 m-85 -78.46 -8.3 58.37 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.369 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.7 p -61.01 -23.54 65.48 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.416 -1.427 . . . . 0.0 111.633 167.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.82 -10.72 59.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.699 -1.25 . . . . 0.0 112.568 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -31.78 71.44 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.725 1.148 . . . . 0.0 111.185 168.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.42 -13.44 62.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.642 1.177 . . . . 0.0 112.312 -173.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -82.87 -29.85 29.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.398 2.279 . . . . 0.0 114.689 173.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -107.97 122.92 47.83 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -164.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.6 p -85.78 -41.84 14.72 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 170.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 56.77 -172.07 0.08 Allowed 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 126.395 1.878 . . . . 0.0 113.175 -170.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -81.37 -27.19 34.97 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -166.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -60.55 147.88 82.28 Favored Pre-proline 0 CA--C 1.546 0.813 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -178.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -77.41 162.21 31.0 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.011 2.474 . . . . 0.0 110.508 167.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 t30 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 124.843 1.257 . . . . 0.0 112.297 177.794 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.902 0 CA-C-O 121.011 0.434 . . . . 0.0 112.05 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.4 44.16 15.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.879 1.672 . . . . 0.0 115.044 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -64.41 -22.37 66.94 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.348 0.659 . . . . 0.0 111.618 167.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.2 t 94.44 104.52 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.407 3.083 . . . . 0.0 116.231 168.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.64 74.89 Favored 'General case' 0 CA--C 1.551 0.996 0 O-C-N 120.711 -1.243 . . . . 0.0 111.191 169.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.454 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 23.4 mtmt -62.61 -28.03 69.61 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.416 1.486 . . . . 0.0 114.178 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -105.91 8.23 32.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.634 1.173 . . . . 0.0 113.478 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 49.2 ttm -63.91 130.34 43.69 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.644 -1.285 . . . . 0.0 110.392 173.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.2 t -79.32 156.28 28.1 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.01 -1.056 . . . . 0.0 110.814 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.25 -32.67 71.37 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.079 -1.638 . . . . 0.0 112.884 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -63.3 -32.13 73.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -74.96 -40.4 60.78 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.646 0.779 . . . . 0.0 111.938 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -60.34 -46.02 91.41 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.221 0.464 . . . . 0.0 111.892 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -72.21 -10.44 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.614 175.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.45 -20.25 20.48 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 170.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 156.0 37.15 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.029 0.932 . . . . 0.0 112.285 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -56.11 135.45 74.44 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.631 1.172 . . . . 0.0 113.203 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -75.39 -5.87 17.12 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.419 1.413 . . . . 0.0 115.474 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 12.8 mttt -70.68 -59.74 2.65 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.48 1.491 . . . . 0.0 109.509 167.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.55 -11.38 59.18 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -177.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 23.8 ttm -53.98 -31.09 49.66 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.611 -1.306 . . . . 0.0 112.92 171.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 36.3 m -68.44 -57.36 8.73 Favored Pre-proline 0 N--CA 1.484 1.254 0 CA-C-O 117.998 -1.001 . . . . 0.0 112.751 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.03 -36.27 75.43 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.83 3.02 . . . . 0.0 114.096 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 60.7 t -64.12 -52.17 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 121.469 -0.769 . . . . 0.0 111.395 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.42 -36.36 80.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.636 1.175 . . . . 0.0 111.372 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.513 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.7 t90 -71.31 -51.12 26.12 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 117.054 -1.45 . . . . 0.0 113.088 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.447 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.91 -27.68 67.69 Favored 'General case' 0 C--N 1.349 0.582 0 C-N-CA 116.911 -1.916 . . . . 0.0 111.139 -169.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.6 tmm? -60.59 -42.1 96.05 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.082 0.953 . . . . 0.0 112.217 169.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -24.4 63.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.046 1.338 . . . . 0.0 114.395 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -109.28 -20.2 13.03 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 62.16 158.28 0.06 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.641 2.776 . . . . 0.0 116.881 -172.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -75.56 -3.27 33.26 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.931 1.692 . . . . 0.0 112.639 171.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 58.6 p -66.6 154.88 39.34 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.011 1.324 . . . . 0.0 112.083 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.6 p -88.33 147.01 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.515 0.726 . . . . 0.0 112.681 -169.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -75.8 159.76 30.69 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.429 1.091 . . . . 0.0 112.824 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 10.2 ptpt -140.02 23.75 2.39 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -168.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 172.48 -55.48 0.17 Allowed Glycine 0 CA--C 1.534 1.224 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 170.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -81.37 178.38 53.89 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 123.722 0.677 . . . . 0.0 114.711 -174.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -65.21 139.03 58.61 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.92 0.888 . . . . 0.0 109.226 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.05 153.06 23.16 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -166.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . 0.306 33.0 m 52.88 19.67 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 128.719 2.808 . . . . 0.0 117.384 171.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -30.99 69.97 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . 0.411 0.3 OUTLIER 61.18 161.2 0.06 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.697 2.399 . . . . 0.0 114.658 -167.059 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -130.13 169.28 15.54 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.854 1.662 . . . . 0.0 111.857 -167.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.2 -26.23 68.7 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.704 -1.247 . . . . 0.0 112.238 171.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 91.1 m -60.77 -43.53 97.92 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.878 0.871 . . . . 0.0 110.72 169.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -65.18 -48.57 73.0 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.748 -0.595 . . . . 0.0 110.25 175.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.47 -29.96 62.35 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 42.5 m -81.07 -36.39 30.53 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.092 0.957 . . . . 0.0 112.187 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -80.24 -30.06 38.48 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.055 -1.028 . . . . 0.0 113.723 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.84 -41.4 84.53 Favored Pre-proline 0 CA--C 1.552 1.052 0 CA-C-N 120.351 1.432 . . . . 0.0 113.629 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -73.29 -37.32 3.39 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 CA-C-N 122.477 1.92 . . . . 0.0 113.468 169.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -67.65 -28.84 68.05 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 120.338 -1.477 . . . . 0.0 114.232 -175.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.25 -26.72 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 118.59 0.632 . . . . 0.0 112.076 173.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 43.6 mt -70.24 -51.27 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 123.927 0.891 . . . . 0.0 109.438 171.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -53.21 -48.85 67.8 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.79 0.836 . . . . 0.0 112.033 173.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -70.09 -25.1 63.36 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.124 -0.985 . . . . 0.0 112.075 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.34 -46.2 28.65 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.635 0.774 . . . . 0.0 112.177 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -26.69 67.36 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 120.389 1.45 . . . . 0.0 113.622 173.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttm -70.28 -31.58 69.0 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 168.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -133.18 65.25 72.77 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 125.046 1.338 . . . . 0.0 112.381 -179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -58.82 -15.29 25.93 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.094 2.529 . . . . 0.0 116.732 -171.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -83.7 -16.42 45.0 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.922 1.289 . . . . 0.0 113.603 -177.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -72.87 153.8 40.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.953 0.901 . . . . 0.0 111.375 -172.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -85.62 132.82 34.1 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.5 tp -51.52 -36.16 43.68 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.454 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 6.1 m-85 -81.76 -6.47 59.08 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.3 p -61.19 -27.55 68.5 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 120.524 -1.36 . . . . 0.0 111.317 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.37 -4.02 23.95 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.472 1.509 . . . . 0.0 114.317 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -29.46 37.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.97 1.308 . . . . 0.0 112.021 167.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.26 -32.31 64.62 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.646 1.178 . . . . 0.0 112.2 -171.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.36 -28.6 67.26 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.697 1.599 . . . . 0.0 114.864 173.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -82.04 -36.08 28.11 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -166.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.7 m 44.97 53.23 7.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.845 1.258 . . . . 0.0 112.466 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.26 165.98 6.79 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.973 1.309 . . . . 0.0 112.651 -172.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -62.47 127.63 32.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -172.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -157.02 161.9 28.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 126.928 2.091 . . . . 0.0 111.374 173.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -59.98 151.49 71.54 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.354 2.702 . . . . 0.0 114.042 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.6 m120 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 124.991 1.316 . . . . 0.0 112.704 177.013 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 121.625 0.726 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.333 0.2 OUTLIER 68.45 33.91 3.89 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.212 1.805 . . . . 0.0 115.289 173.271 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -73.04 163.47 28.11 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 126.041 1.736 . . . . 0.0 106.438 162.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.8 t -102.57 103.44 13.77 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.367 1.467 . . . . 0.0 113.091 -164.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.99 70.52 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.434 -1.416 . . . . 0.0 110.748 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.0 ptpt -74.1 -4.69 37.14 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -125.83 12.29 7.87 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.151 1.381 . . . . 0.0 112.139 168.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.0 ttm -60.6 122.44 14.72 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.623 -1.298 . . . . 0.0 108.544 170.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.9 t -75.96 154.64 35.72 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.867 -1.146 . . . . 0.0 110.421 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.66 -30.94 71.97 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.267 -1.521 . . . . 0.0 113.342 -172.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -40.72 97.52 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.017 0.826 . . . . 0.0 111.928 170.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.69 -37.36 82.2 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.199 1.0 . . . . 0.0 111.568 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.65 -51.86 67.62 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.563 0.745 . . . . 0.0 112.353 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -69.43 -1.77 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 124.554 1.142 . . . . 0.0 112.737 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -106.59 -7.58 17.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.483 1.513 . . . . 0.0 113.587 171.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.14 160.71 29.48 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.021 -1.049 . . . . 0.0 111.135 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.2 t-20 -66.0 128.76 94.04 Favored Pre-proline 0 N--CA 1.484 1.273 0 O-C-N 121.024 -1.047 . . . . 0.0 111.528 -175.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.6 -21.02 23.11 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 124.094 3.196 . . . . 0.0 115.607 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.8 mptt -57.89 -68.07 0.28 Allowed 'General case' 0 C--N 1.351 0.639 0 C-N-CA 126.117 1.767 . . . . 0.0 109.539 168.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.17 -7.9 57.64 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 10.9 ttt -62.84 -35.86 81.33 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.291 -1.505 . . . . 0.0 113.206 170.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.4 m -60.43 -53.66 62.53 Favored Pre-proline 0 N--CA 1.485 1.311 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.419 ' HA ' ' CE2' ' B' ' 106' ' ' TRP . 2.7 Cg_endo -49.31 -47.12 23.38 Favored 'Trans proline' 0 CA--C 1.51 -0.694 0 C-N-CA 123.389 2.726 . . . . 0.0 114.133 167.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.2 t -57.88 -32.94 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.807 0.443 . . . . 0.0 111.793 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.96 -27.42 65.71 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.385 1.074 . . . . 0.0 113.579 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.415 ' CB ' ' CH2' ' B' ' 106' ' ' TRP . 52.4 t90 -88.14 -39.38 14.58 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.81 1.186 . . . . 0.0 109.993 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.537 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 3.6 m95 -62.76 -35.08 78.67 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -167.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -72.85 -47.61 44.65 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.257 1.423 . . . . 0.0 112.787 168.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -73.99 -28.71 61.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.829 1.251 . . . . 0.0 114.12 -168.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -116.6 -5.76 11.65 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.015 1.326 . . . . 0.0 114.365 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 61.99 168.48 0.11 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 127.444 2.298 . . . . 0.0 116.69 175.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.94 0.03 12.34 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 125.972 1.709 . . . . 0.0 114.422 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.8 t -75.95 -179.34 4.82 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.54 1.936 . . . . 0.0 113.978 -176.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 p -110.78 146.31 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.445 1.498 . . . . 0.0 112.297 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -71.18 161.7 30.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.888 1.275 . . . . 0.0 113.479 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmpt? -78.62 -18.77 54.0 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -169.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -171.62 -22.27 0.02 OUTLIER Glycine 0 CA--C 1.534 1.261 0 N-CA-C 116.263 1.265 . . . . 0.0 116.263 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.38 -172.89 33.82 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 118.934 1.367 . . . . 0.0 114.586 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -132.41 11.77 4.52 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.79 1.636 . . . . 0.0 114.17 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.6 m -76.95 72.17 3.5 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.882 1.273 . . . . 0.0 112.159 -170.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.7 m -64.23 -11.46 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.789 1.235 . . . . 0.0 114.033 177.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.99 145.43 10.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.711 2.004 . . . . 0.0 113.154 175.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 38.2 mt -69.96 117.08 11.08 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.232 0.613 . . . . 0.0 109.703 172.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -80.44 170.85 15.82 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.841 1.256 . . . . 0.0 109.761 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -65.53 -24.93 67.24 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.855 -1.778 . . . . 0.0 112.531 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.7 m -65.84 -46.32 78.97 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.414 -0.804 . . . . 0.0 110.833 168.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -58.61 -48.47 80.86 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.898 0.772 . . . . 0.0 110.245 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.49 -25.15 68.13 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.141 -0.975 . . . . 0.0 112.439 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.0 m -78.54 -37.98 41.56 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.592 0.757 . . . . 0.0 111.467 171.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -81.7 -30.85 32.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.974 -1.012 . . . . 0.0 113.148 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.04 -41.68 75.56 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-O 117.232 -1.366 . . . . 0.0 113.008 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.95 -37.85 2.59 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 122.336 1.87 . . . . 0.0 113.807 168.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -67.82 -33.41 74.74 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.032 -1.667 . . . . 0.0 113.633 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 19.1 m -68.32 -13.95 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.4 mt -92.09 -51.09 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.635 1.174 . . . . 0.0 110.578 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.89 -35.52 73.15 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.974 0.909 . . . . 0.0 111.771 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -68.53 -29.62 68.24 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 122.078 -0.389 . . . . 0.0 111.915 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.27 -45.7 31.44 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.838 -1.164 . . . . 0.0 112.745 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.54 68.79 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.644 1.566 . . . . 0.0 113.977 177.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -77.06 -32.82 57.14 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -133.2 77.22 67.4 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 124.639 1.176 . . . . 0.0 112.094 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.55 -9.96 3.13 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 124.772 3.648 . . . . 0.0 117.024 175.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.39 -25.57 51.0 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.045 1.338 . . . . 0.0 112.511 -177.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -67.13 153.59 43.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.926 1.291 . . . . 0.0 111.448 -172.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -87.38 131.61 34.23 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 169.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -51.72 -36.72 47.99 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -169.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.482 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.0 m-85 -79.57 -6.85 57.9 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 58.8 p -59.79 -26.7 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.458 -1.401 . . . . 0.0 111.053 167.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -71.84 -3.1 20.35 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.754 1.622 . . . . 0.0 114.143 177.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -31.65 25.5 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.976 1.31 . . . . 0.0 111.693 169.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.3 -26.19 64.61 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.27 1.028 . . . . 0.0 112.151 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -74.85 -29.51 61.07 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.563 1.545 . . . . 0.0 114.929 171.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.85 111.72 24.02 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.04 1.336 . . . . 0.0 114.604 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.8 p -74.65 -31.01 61.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.148 0.979 . . . . 0.0 112.433 168.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 47.9 t30 50.19 -143.27 0.59 Allowed 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 126.76 2.024 . . . . 0.0 113.285 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -139.93 119.96 13.63 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.309 1.443 . . . . 0.0 111.133 173.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.2 mp -105.55 120.67 48.62 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.339 1.056 . . . . 0.0 110.188 -178.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_exo -57.57 123.64 14.23 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.584 2.856 . . . . 0.0 113.567 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.4 p30 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.229 1.812 . . . . 0.0 112.531 -172.846 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.0 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.282 10.7 t-20 63.5 35.21 12.09 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.109 1.433 . . . . 0.0 114.313 177.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.04 159.13 34.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.142 1.777 . . . . 0.0 106.8 164.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 15.6 t -93.94 97.56 10.44 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -166.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.74 -33.25 64.11 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 120.944 -1.098 . . . . 0.0 111.091 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -64.41 -31.33 72.49 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.537 1.935 . . . . 0.0 114.608 177.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -114.26 13.9 17.98 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.925 1.29 . . . . 0.0 113.132 -177.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.0 ttm -58.77 122.31 13.25 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.919 -1.113 . . . . 0.0 108.888 169.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.6 t -77.46 156.84 30.81 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.876 -1.14 . . . . 0.0 110.682 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.04 -34.06 76.76 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.142 -1.598 . . . . 0.0 112.909 -173.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -65.1 -31.45 72.66 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.192 0.906 . . . . 0.0 112.595 173.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -77.63 -37.08 50.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.784 1.234 . . . . 0.0 111.35 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -62.51 -49.42 75.44 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.331 -0.856 . . . . 0.0 112.28 176.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.05 -7.61 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.683 0.793 . . . . 0.0 112.971 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -100.88 -13.91 18.16 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.936 1.694 . . . . 0.0 113.877 171.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.34 158.42 35.11 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.454 1.025 . . . . 0.0 111.114 173.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -62.33 133.91 94.62 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.894 0.878 . . . . 0.0 112.815 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.43 -13.88 33.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.789 2.326 . . . . 0.0 116.042 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -66.38 -50.41 63.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 121.151 1.796 . . . . 0.0 107.929 168.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -87.98 -5.18 58.66 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 25.0 mtt -55.46 -44.48 76.44 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.652 -1.28 . . . . 0.0 111.98 169.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 89.4 m -61.17 -52.62 70.16 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 124.666 1.186 . . . . 0.0 113.088 -175.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . 0.462 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 11.6 Cg_endo -52.97 -49.75 16.48 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 124.047 3.165 . . . . 0.0 114.983 171.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.06 -37.05 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.672 -1.268 . . . . 0.0 112.867 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.38 -29.8 70.74 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.593 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.537 ' CD2' ' CZ2' ' A' ' 27' ' ' TRP . 73.2 t90 -81.81 -46.42 14.2 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.191 1.359 . . . . 0.0 112.452 173.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.419 ' CE2' ' HA ' ' A' ' 23' ' ' PRO . 0.0 OUTLIER -41.02 -38.55 1.01 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.703 0.801 . . . . 0.0 111.962 169.485 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 57.5 ttp -75.08 -64.58 1.02 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.409 1.484 . . . . 0.0 113.849 169.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.39 -31.06 65.42 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -170.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -125.64 21.66 7.7 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -171.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 58.53 93.75 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 116.759 2.133 . . . . 0.0 116.759 169.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 13.7 tm-20 -57.78 -27.71 63.34 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.299 -0.876 . . . . 0.0 111.686 166.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 18.7 p -71.41 39.18 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.878 2.871 . . . . 0.0 114.841 -177.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . 0.287 0.5 OUTLIER 71.31 152.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 128.184 2.594 . . . . 0.0 115.634 178.357 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -101.63 176.8 5.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.623 1.569 . . . . 0.0 113.373 -170.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt -147.91 163.77 35.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.685 1.594 . . . . 0.0 112.001 -174.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.41 -105.06 1.33 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 123.763 0.696 . . . . 0.0 113.126 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -165.89 150.78 18.67 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.042 0.829 . . . . 0.0 113.861 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.309 4.7 p-10 38.28 -127.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.772 2.029 . . . . 0.0 114.269 -175.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . 0.25 41.5 p 47.8 -0.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 28.5 m -63.53 -2.74 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 127.006 2.123 . . . . 0.0 114.501 172.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.8 159.65 5.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.394 1.478 . . . . 0.0 112.1 169.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 66.0 tp -76.97 120.95 22.8 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 165.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -103.53 164.62 11.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.306 1.042 . . . . 0.0 112.536 -169.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.51 -26.67 67.27 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.286 -1.509 . . . . 0.0 112.586 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.6 m -62.99 -45.4 92.58 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.507 -0.746 . . . . 0.0 110.919 169.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.32 -55.57 33.06 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.712 0.687 . . . . 0.0 109.473 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.2 mt -54.57 -33.67 60.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.145 0.978 . . . . 0.0 112.881 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 51.9 m -77.51 -35.2 53.74 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.664 0.786 . . . . 0.0 111.92 175.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -81.22 -23.46 38.09 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.94 -47.05 96.87 Favored Pre-proline 0 N--CA 1.482 1.126 0 CA-C-N 120.305 1.411 . . . . 0.0 112.338 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.3 -34.95 14.98 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 122.065 1.773 . . . . 0.0 113.612 172.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -66.0 -32.06 73.33 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.625 -1.297 . . . . 0.0 113.539 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.91 -28.31 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 61.5 mt -69.55 -49.53 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.883 0.873 . . . . 0.0 109.8 172.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.39 -53.52 56.41 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.712 0.805 . . . . 0.0 111.208 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -62.56 -26.41 68.56 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.073 -1.017 . . . . 0.0 113.068 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.75 -48.01 17.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.187 0.903 . . . . 0.0 112.561 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -25.2 67.1 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 121.059 1.754 . . . . 0.0 113.653 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -73.45 -28.02 61.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.725 1.61 . . . . 0.0 114.478 168.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -135.01 63.65 58.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.122 1.369 . . . . 0.0 110.735 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -63.82 -12.42 31.6 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.403 2.735 . . . . 0.0 115.871 -168.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.16 -17.01 38.5 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.348 1.459 . . . . 0.0 113.447 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -74.32 161.38 29.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.536 1.135 . . . . 0.0 111.985 -173.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -75.02 159.99 31.08 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.68 -0.638 . . . . 0.0 109.772 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.9 tp -70.8 -62.91 1.22 Allowed 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.586 -0.696 . . . . 0.0 112.257 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -61.52 -24.0 66.31 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 -167.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.7 t -57.46 -23.68 51.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.742 -0.599 . . . . 0.0 112.066 172.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -63.85 -3.46 2.46 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 119.789 -1.819 . . . . 0.0 114.5 174.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -35.38 63.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.235 1.379 . . . . 0.0 111.396 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -33.56 75.89 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -167.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -67.53 -27.22 66.79 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.541 1.937 . . . . 0.0 115.053 172.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -101.43 106.27 17.38 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.102 1.361 . . . . 0.0 113.845 -167.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 50.8 m -77.59 73.12 4.16 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.241 1.016 . . . . 0.0 110.258 169.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -69.54 172.54 7.16 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.698 1.199 . . . . 0.0 112.591 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -77.13 49.64 0.69 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.009 1.723 . . . . 0.0 114.259 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.12 152.64 44.52 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.546 2.338 . . . . 0.0 111.208 172.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.64 161.29 37.09 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.055 2.503 . . . . 0.0 112.852 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.342 0 C-N-CA 125.659 1.584 . . . . 0.0 111.092 178.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.09 0 CA-C-O 121.226 0.536 . . . . 0.0 112.327 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.264 45.8 t30 60.34 42.6 14.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.101 1.76 . . . . 0.0 115.041 175.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' HB3' ' HE3' ' B' ' 98' ' ' LYS . 23.3 mm-40 -59.31 -26.12 64.73 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.724 0.81 . . . . 0.0 111.475 166.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t 97.78 106.52 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 129.647 3.179 . . . . 0.0 114.682 168.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.49 -31.0 70.97 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.708 -1.245 . . . . 0.0 111.347 170.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 9.1 mtmt -63.65 -25.08 68.05 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.449 1.5 . . . . 0.0 114.366 175.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.09 5.85 28.33 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.829 1.252 . . . . 0.0 113.356 175.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 41.4 ttm -62.03 125.31 23.43 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.656 -1.277 . . . . 0.0 109.922 173.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -78.57 155.92 29.42 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.842 -1.161 . . . . 0.0 110.187 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.63 -35.71 78.66 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.588 -1.32 . . . . 0.0 112.84 -174.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -61.69 -35.03 76.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 172.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -77.09 -37.38 54.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.653 1.181 . . . . 0.0 111.342 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -60.49 -49.91 75.65 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.619 -0.675 . . . . 0.0 112.378 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.5 pt -69.49 -1.68 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 124.394 1.078 . . . . 0.0 112.663 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -110.0 -12.27 14.55 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.522 1.529 . . . . 0.0 113.897 174.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.25 163.08 25.81 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 121.02 -1.05 . . . . 0.0 110.5 169.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -66.1 131.18 94.42 Favored Pre-proline 0 N--CA 1.483 1.192 0 O-C-N 120.745 -1.222 . . . . 0.0 112.05 -178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_exo -61.39 -16.3 46.37 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.459 2.772 . . . . 0.0 115.415 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -56.93 -61.74 2.23 Favored 'General case' 0 C--N 1.35 0.61 0 C-N-CA 125.983 1.713 . . . . 0.0 108.814 168.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.44 -7.74 59.63 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 86.5 mtp -58.86 -37.0 75.52 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 120.403 1.456 . . . . 0.0 112.859 171.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.9 m -62.04 -55.96 36.06 Favored Pre-proline 0 N--CA 1.486 1.344 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -56.21 -39.05 93.72 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.265 2.643 . . . . 0.0 112.885 169.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 99.1 t -60.39 -42.84 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 120.033 -1.667 . . . . 0.0 111.969 175.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.34 -41.98 79.97 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.082 0.953 . . . . 0.0 110.962 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . 0.267 0.0 OUTLIER -73.34 -41.58 63.3 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 115.974 -1.965 . . . . 0.0 111.404 177.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.484 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 0.3 OUTLIER -65.58 -25.22 67.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.644 2.474 . . . . 0.0 113.85 175.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -67.04 -45.52 77.17 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.808 -0.557 . . . . 0.0 111.144 168.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.52 -35.14 73.02 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 113.734 -177.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -133.68 102.51 5.5 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.446 2.298 . . . . 0.0 108.049 172.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.522 ' C ' ' H ' ' A' ' 33' ' ' THR . 49.0 mt-10 -67.24 -178.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.916 1.287 . . . . 0.0 113.375 -174.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -66.51 18.11 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 125.364 1.465 . . . . 0.0 113.073 167.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.522 ' H ' ' C ' ' A' ' 31' ' ' GLU . 13.1 t -74.48 156.45 36.91 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.399 2.28 . . . . 0.0 112.462 173.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.417 ' O ' ' HE2' ' A' ' 36' ' ' LYS . 84.0 t -81.0 133.44 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.394 1.078 . . . . 0.0 109.862 176.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -66.04 22.97 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 129.198 2.999 . . . . 0.0 118.126 -169.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' A' ' 34' ' ' VAL . 22.8 mmtt 60.83 15.28 5.82 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 126.196 1.798 . . . . 0.0 115.605 171.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.95 1.87 72.49 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.388 1.47 . . . . 0.0 115.085 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.17 179.41 48.0 Favored Glycine 0 CA--C 1.539 1.592 0 CA-C-N 118.636 1.218 . . . . 0.0 112.813 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -75.84 119.75 20.25 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.657 -0.908 . . . . 0.0 110.617 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.4 m -68.11 138.66 55.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.942 0.897 . . . . 0.0 112.447 -169.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . 0.3 11.0 m 56.26 4.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 128.969 2.908 . . . . 0.0 118.025 -176.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 154.41 41.25 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.227 1.376 . . . . 0.0 112.79 171.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -147.73 169.29 20.03 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.201 1.4 . . . . 0.0 112.475 -179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -133.04 174.63 10.15 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.868 2.067 . . . . 0.0 110.889 -169.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -63.15 -24.58 67.96 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.805 -1.185 . . . . 0.0 112.433 171.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.3 m -58.64 -47.47 84.3 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.503 -0.748 . . . . 0.0 110.985 168.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -61.86 -44.11 97.49 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.414 -0.804 . . . . 0.0 110.062 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 68.3 mt -64.57 -19.24 65.53 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.143 0.977 . . . . 0.0 112.954 175.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.5 m -89.15 -27.63 20.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.529 1.932 . . . . 0.0 112.323 173.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -83.45 -33.98 25.54 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 120.814 -1.178 . . . . 0.0 111.823 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.52 -42.76 89.76 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-O 117.227 -1.368 . . . . 0.0 113.535 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.13 -39.77 7.25 Favored 'Trans proline' 0 C--N 1.35 0.654 0 CA-C-N 122.571 1.954 . . . . 0.0 112.845 169.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -62.94 -38.81 92.53 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.625 1.557 . . . . 0.0 113.461 -176.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.0 m -70.41 -19.54 22.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.372 0.669 . . . . 0.0 112.491 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.8 mt -81.36 -47.99 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.316 -0.865 . . . . 0.0 109.933 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.84 -37.22 78.64 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.101 0.96 . . . . 0.0 112.008 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -68.62 -26.23 65.25 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.695 0.679 . . . . 0.0 111.758 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.0 m -77.65 -46.74 21.11 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.234 -0.916 . . . . 0.0 112.89 174.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -29.17 67.95 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 120.799 1.636 . . . . 0.0 114.166 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.66 -27.76 55.72 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -135.16 74.31 62.59 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.996 1.318 . . . . 0.0 112.073 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -59.03 -9.66 8.39 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 124.36 3.373 . . . . 0.0 117.371 -177.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -82.21 -22.11 36.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.981 1.312 . . . . 0.0 113.139 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? -68.9 157.7 36.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.3 1.04 . . . . 0.0 111.7 -174.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -75.86 152.39 37.21 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 169.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.5 -39.92 81.1 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.015 -1.053 . . . . 0.0 113.087 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.2 m-85 -86.68 -19.28 29.46 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -58.97 -23.46 61.7 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.318 -0.864 . . . . 0.0 111.671 170.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -58.19 -15.81 11.27 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.761 -1.837 . . . . 0.0 112.902 171.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.3 tptt -58.58 -35.28 72.15 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.045 -1.034 . . . . 0.0 112.597 168.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.16 -26.03 67.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.714 0.806 . . . . 0.0 112.208 -169.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -68.48 -30.21 69.0 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.894 2.078 . . . . 0.0 114.233 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -112.78 106.96 15.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -165.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.0 p -107.49 2.18 24.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.61 1.564 . . . . 0.0 114.894 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -63.04 159.37 17.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -169.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.5 t70 67.27 -40.69 0.4 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 128.678 2.791 . . . . 0.0 116.177 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.4 mt -68.21 128.46 93.2 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 124.678 1.191 . . . . 0.0 111.35 -177.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.85 167.2 27.61 Favored 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.063 2.509 . . . . 0.0 112.532 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.354 0 C-N-CA 125.932 1.693 . . . . 0.0 113.213 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.303 0.3 OUTLIER 66.97 36.03 4.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.303 1.441 . . . . 0.0 114.622 172.774 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -75.06 160.54 30.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.215 1.806 . . . . 0.0 106.201 163.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.2 t -97.84 98.36 9.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 120.948 -1.095 . . . . 0.0 113.89 -166.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.52 62.79 Favored 'General case' 0 CA--C 1.555 1.164 0 O-C-N 120.771 -1.205 . . . . 0.0 110.815 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt -59.7 -30.78 69.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.988 2.115 . . . . 0.0 115.03 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -117.52 12.69 14.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.837 1.255 . . . . 0.0 113.107 -175.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 54.4 ttm -60.88 119.7 8.74 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.002 -1.061 . . . . 0.0 108.949 169.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -75.95 156.42 34.19 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.115 -0.99 . . . . 0.0 110.422 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -33.19 73.86 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.486 -1.384 . . . . 0.0 112.957 -172.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -65.75 -32.87 74.66 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.153 0.888 . . . . 0.0 112.865 173.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -77.41 -35.6 54.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.274 1.43 . . . . 0.0 111.17 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.51 -51.36 65.83 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.307 1.043 . . . . 0.0 112.411 175.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.9 pt -68.01 -4.03 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -103.01 -11.25 18.3 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.088 1.755 . . . . 0.0 114.182 170.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.17 157.61 37.31 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.983 1.265 . . . . 0.0 110.748 171.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . 0.262 0.1 OUTLIER -73.37 146.51 86.61 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -169.66 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -71.84 -10.55 26.51 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.865 1.71 . . . . 0.0 114.717 -177.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' A' ' 3' ' ' GLU . 5.8 mptt -67.81 -55.44 12.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.876 1.216 . . . . 0.0 108.572 167.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.65 -13.96 52.98 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.9 mmt -47.69 -43.43 26.55 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.742 1.156 . . . . 0.0 112.581 171.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -61.3 -55.31 44.77 Favored Pre-proline 0 N--CA 1.481 1.111 0 C-N-CA 124.535 1.134 . . . . 0.0 113.606 -171.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . 0.434 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 14.0 Cg_endo -54.7 -47.4 26.92 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.471 2.781 . . . . 0.0 114.513 171.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.7 p -70.17 -34.54 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 120.574 -1.329 . . . . 0.0 113.095 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.61 -25.21 67.28 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.671 0.788 . . . . 0.0 111.746 173.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.484 ' CG ' ' CZ2' ' A' ' 27' ' ' TRP . 62.6 t90 -80.78 -50.27 10.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.436 1.017 . . . . 0.0 111.254 168.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -50.45 -44.37 55.47 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 121.696 0.76 . . . . 0.0 112.258 -172.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -64.47 -45.36 87.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.317 1.047 . . . . 0.0 112.045 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.83 -29.67 58.71 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.072 1.349 . . . . 0.0 113.012 -171.11 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . 0.547 ' CG ' HD21 ' B' ' 154' ' ' ASN . 1.6 t60 -126.75 -17.66 4.93 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 116.398 1.999 . . . . 0.0 116.398 -173.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 65.39 156.4 0.09 Allowed 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 174.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -88.89 5.55 43.38 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.571 1.548 . . . . 0.0 113.836 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 15.8 p -63.12 137.58 58.28 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.403 -0.811 . . . . 0.0 110.389 169.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 4.4 p -64.89 139.35 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -76.7 160.02 29.69 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.131 0.972 . . . . 0.0 111.701 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.27 62.82 0.61 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.582 1.553 . . . . 0.0 112.063 -178.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 87.38 6.2 78.19 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 125.581 1.562 . . . . 0.0 115.52 -177.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -88.64 162.9 32.0 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.603 1.097 . . . . 0.0 114.019 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -135.09 19.78 3.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.605 1.562 . . . . 0.0 113.499 -177.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 47.5 p -71.09 7.1 1.32 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.255 1.946 . . . . 0.0 116.255 -168.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 9.1 m -58.82 -15.31 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 125.596 1.558 . . . . 0.0 112.636 167.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 11.9 p -50.0 -25.62 3.52 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.943 2.097 . . . . 0.0 114.618 168.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 53.2 mt 68.07 79.51 0.22 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 127.665 2.386 . . . . 0.0 111.219 -169.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -60.57 165.68 3.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.912 169.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.87 -23.51 65.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -172.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.2 m -68.05 -47.76 67.48 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.117 0.871 . . . . 0.0 110.618 171.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.91 -49.77 76.55 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.454 1.025 . . . . 0.0 111.65 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -32.64 67.51 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 59.3 m -78.57 -36.04 45.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.701 0.8 . . . . 0.0 111.796 175.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -81.42 -32.96 32.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 117.428 -1.273 . . . . 0.0 114.421 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -48.11 -47.92 64.75 Favored Pre-proline 0 N--CA 1.482 1.157 0 CA-C-N 120.667 1.576 . . . . 0.0 113.175 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.92 -32.26 29.29 Favored 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 122.116 1.791 . . . . 0.0 113.811 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -65.2 -30.78 71.71 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.584 -1.322 . . . . 0.0 113.456 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.55 -31.76 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.285 0.493 . . . . 0.0 111.267 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -71.84 -50.77 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.564 1.146 . . . . 0.0 109.847 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.85 -39.96 82.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.414 0.686 . . . . 0.0 112.453 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -71.43 -27.44 63.29 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 118.828 0.74 . . . . 0.0 112.725 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -73.84 -47.99 34.44 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.403 -0.811 . . . . 0.0 112.478 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -26.79 67.82 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 120.359 1.436 . . . . 0.0 114.832 -178.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -80.67 -16.93 52.75 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -137.78 65.34 45.91 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 125.425 1.49 . . . . 0.0 111.463 174.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -64.12 -11.59 28.33 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.856 3.037 . . . . 0.0 115.923 -169.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -83.99 -17.1 41.62 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.014 1.325 . . . . 0.0 113.328 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -74.01 158.95 33.39 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.615 1.166 . . . . 0.0 111.545 -174.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.63 154.05 27.61 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.674 -0.641 . . . . 0.0 110.094 172.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -66.3 -44.9 82.18 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.24 -0.913 . . . . 0.0 113.044 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -77.55 -19.77 55.19 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -169.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 12.6 t -64.45 -16.4 62.36 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.738 -1.226 . . . . 0.0 112.412 169.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -67.56 -2.97 7.47 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.348 -2.095 . . . . 0.0 113.499 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -27.95 35.71 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.28 1.432 . . . . 0.0 112.293 167.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -64.36 -35.44 80.89 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.899 1.28 . . . . 0.0 112.049 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -72.1 -28.35 63.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.445 1.898 . . . . 0.0 115.403 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -104.55 102.14 11.77 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -166.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 55.8 m -84.21 79.18 9.62 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.688 1.195 . . . . 0.0 109.558 168.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . 0.547 HD21 ' CG ' ' B' ' 109' ' ' HIS . 53.9 t30 -73.24 170.43 15.01 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -169.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -71.38 91.63 1.02 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.63 1.572 . . . . 0.0 113.904 -173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -141.89 161.11 53.15 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.119 2.168 . . . . 0.0 110.563 170.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -58.88 130.33 36.26 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.078 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 6.8 p30 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.791 1.636 . . . . 0.0 112.636 -174.802 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 14.2 t-20 69.14 71.0 0.26 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 124.053 1.882 . . . . 0.0 111.74 -177.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.12 156.13 35.6 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 130.868 3.667 . . . . 0.0 103.614 168.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 m -94.9 87.72 5.06 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 125.331 1.452 . . . . 0.0 112.458 -163.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.29 -34.55 70.66 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 121.026 1.739 . . . . 0.0 110.706 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -20.52 62.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.72 2.408 . . . . 0.0 113.969 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -125.16 18.35 8.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.338 1.455 . . . . 0.0 112.145 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.7 ttm -60.62 119.67 8.55 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 169.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.68 154.8 36.29 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.069 -1.02 . . . . 0.0 109.458 -178.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.4 -34.62 75.66 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.466 -1.396 . . . . 0.0 112.951 -173.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -63.06 -34.62 77.98 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 172.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -76.14 -37.84 57.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.225 1.41 . . . . 0.0 111.253 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -62.14 -48.69 78.98 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.207 -0.933 . . . . 0.0 112.343 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.0 pt -70.35 -2.22 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 C-N-CA 123.671 0.788 . . . . 0.0 112.672 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -107.62 -15.33 14.61 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.86 1.664 . . . . 0.0 113.684 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.24 159.13 24.42 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.02 -1.05 . . . . 0.0 110.261 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.519 HD22 ' HD3' ' A' ' 19' ' ' LYS . 47.9 t-20 -67.01 128.09 93.75 Favored Pre-proline 0 N--CA 1.478 0.961 0 O-C-N 121.269 -0.894 . . . . 0.0 109.346 177.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -65.68 -20.72 59.47 Favored 'Trans proline' 0 N--CA 1.444 -1.397 0 C-N-CA 122.48 2.12 . . . . 0.0 111.636 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.519 ' HD3' HD22 ' A' ' 17' ' ' ASN . 4.8 mptt -48.79 -52.44 23.93 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 120.273 1.397 . . . . 0.0 108.697 169.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.66 0.04 40.45 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 31.6 mtt -65.89 -49.71 67.09 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 120.121 1.328 . . . . 0.0 112.199 173.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.25 -54.69 11.22 Favored Pre-proline 0 N--CA 1.49 1.564 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -176.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -60.05 -42.38 44.46 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.324 2.016 . . . . 0.0 113.725 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.0 t -63.2 -45.82 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.336 0.971 . . . . 0.0 111.023 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.61 91.13 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.71 1.204 . . . . 0.0 111.109 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 73.8 t90 -68.87 -52.99 23.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 117.794 -1.098 . . . . 0.0 112.651 170.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.57 -41.73 61.37 Favored 'General case' 0 C--N 1.347 0.486 0 CA-C-O 122.428 1.109 . . . . 0.0 111.491 -174.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -66.18 -44.29 84.42 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.488 1.515 . . . . 0.0 112.143 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -25.28 67.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.502 ' CD2' HD22 ' A' ' 75' ' ' ASN . 74.9 m-70 -107.7 -14.12 14.88 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 64.83 156.64 0.08 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.657 1.983 . . . . 0.0 112.386 -167.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -68.36 11.82 0.15 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 120.012 -1.68 . . . . 0.0 114.823 178.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 t -71.0 158.21 36.91 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.109 1.763 . . . . 0.0 113.452 -173.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.1 t -79.39 135.95 24.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 125.033 1.333 . . . . 0.0 109.643 174.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.46 168.84 18.91 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.82 -151.14 0.41 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.908 1.683 . . . . 0.0 111.332 -169.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.59 -21.32 72.65 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 124.114 0.864 . . . . 0.0 115.152 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -88.6 170.41 38.49 Favored Glycine 0 CA--C 1.537 1.447 0 CA-C-N 118.582 1.191 . . . . 0.0 113.629 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -107.4 12.24 28.17 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.124 1.37 . . . . 0.0 112.793 174.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.4 p -71.16 23.07 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.724 2.12 . . . . 0.0 116.724 -168.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.7 m -59.4 -22.85 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.655 0.782 . . . . 0.0 111.192 166.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -49.32 141.41 8.77 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 126.036 1.734 . . . . 0.0 112.569 169.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 54.2 mt -57.27 135.47 56.47 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 167.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.82 160.67 39.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.359 2.263 . . . . 0.0 109.854 -169.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.16 -18.57 64.58 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 119.547 -1.97 . . . . 0.0 114.497 -168.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 37.5 m -70.77 -58.54 3.52 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.901 -0.499 . . . . 0.0 110.719 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -65.89 -30.73 71.38 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.811 1.187 . . . . 0.0 113.198 -179.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.97 -27.69 68.34 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.773 1.169 . . . . 0.0 111.963 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.0 m -74.55 -36.99 63.12 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.701 0.4 . . . . 0.0 110.33 169.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -84.09 -27.24 28.38 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -174.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.94 -41.02 77.1 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 121.212 1.824 . . . . 0.0 112.489 176.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.48 -38.0 2.82 Favored 'Trans proline' 0 C--N 1.353 0.777 0 CA-C-N 122.301 1.858 . . . . 0.0 113.432 168.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -66.95 -30.68 70.88 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.509 -1.37 . . . . 0.0 113.802 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.9 m -70.47 -20.98 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.097 0.862 . . . . 0.0 112.556 173.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 mt -81.78 -50.73 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 O-C-N 121.48 -0.763 . . . . 0.0 110.242 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.38 -41.81 85.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.835 0.854 . . . . 0.0 111.747 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -70.89 -22.75 62.24 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.994 -1.066 . . . . 0.0 111.725 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.5 m -79.44 -45.25 19.8 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.498 172.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -27.49 68.89 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.825 1.648 . . . . 0.0 113.761 173.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -69.15 -38.15 78.63 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 168.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -128.74 68.44 78.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.791 1.236 . . . . 0.0 112.143 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -55.59 -15.8 13.09 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.471 2.781 . . . . 0.0 115.883 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -80.14 -25.05 40.03 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.918 1.687 . . . . 0.0 113.268 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -75.55 162.89 27.9 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.07 1.348 . . . . 0.0 112.186 -170.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -77.34 150.6 35.17 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.584 -0.697 . . . . 0.0 109.175 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.7 tp -67.28 -33.85 76.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -88.78 -22.59 23.2 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -169.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.7 t -59.74 -21.09 60.23 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.508 -0.745 . . . . 0.0 111.842 169.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -58.57 -14.62 8.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 119.529 -1.982 . . . . 0.0 113.747 171.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -34.33 72.7 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.101 1.319 . . . . 0.0 111.845 166.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -25.51 66.57 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.663 0.744 . . . . 0.0 112.447 -170.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -66.65 -33.85 76.57 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.602 1.961 . . . . 0.0 113.938 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.97 134.29 43.11 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -165.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.9 p -76.43 -50.75 13.3 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.177 0.991 . . . . 0.0 112.148 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.502 HD22 ' CD2' ' A' ' 30' ' ' HIS . 15.4 t-20 61.53 164.9 0.09 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 127.778 2.431 . . . . 0.0 114.188 -177.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -85.05 17.31 2.98 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 116.348 1.981 . . . . 0.0 116.348 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.55 158.11 88.54 Favored Pre-proline 0 CA--C 1.553 1.09 0 O-C-N 120.906 -1.121 . . . . 0.0 112.598 171.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.7 151.97 59.69 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.177 2.584 . . . . 0.0 114.185 176.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.036 1.334 . . . . 0.0 112.596 178.817 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 121.644 0.735 . . . . 0.0 111.874 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -132.41 55.78 1.87 Allowed 'General case' 0 C--O 1.211 -0.94 1 N-CA-C 99.345 -4.317 . . . . 0.0 99.345 166.951 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.272 9.6 mt-10 62.86 -175.26 0.15 Allowed 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.962 -1.086 . . . . 0.0 109.041 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' SER . . . . . 0.431 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 37.1 t -129.33 113.18 14.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.982 1.713 . . . . 0.0 113.804 -169.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.34 -32.59 72.48 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 119.702 -1.874 . . . . 0.0 111.354 169.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -62.18 -24.16 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.814 2.045 . . . . 0.0 114.048 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -115.64 11.43 15.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.368 1.467 . . . . 0.0 113.369 176.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 51.3 ttm -62.88 125.44 23.97 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.644 -1.285 . . . . 0.0 109.939 171.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 155.66 31.14 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.04 -1.038 . . . . 0.0 110.487 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.8 -32.01 73.5 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.163 -1.585 . . . . 0.0 113.186 -172.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.44 -30.94 71.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.804 0.729 . . . . 0.0 112.663 171.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -81.53 -33.88 31.52 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.859 1.664 . . . . 0.0 111.32 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -64.12 -48.51 75.8 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.854 0.861 . . . . 0.0 112.987 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.1 pt -68.9 -4.12 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 176.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.98 -11.48 16.64 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.222 1.809 . . . . 0.0 114.081 172.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 158.41 36.2 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.928 1.24 . . . . 0.0 110.856 175.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -64.45 132.88 95.5 Favored Pre-proline 0 CA--C 1.551 1.003 0 O-C-N 121.246 -0.909 . . . . 0.0 111.871 -179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -63.81 -15.03 46.58 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.921 2.414 . . . . 0.0 114.5 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -55.51 -67.22 0.3 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.325 1.45 . . . . 0.0 108.868 167.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.91 -14.35 60.64 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 33.3 ttm -56.48 -34.56 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.882 -1.136 . . . . 0.0 113.081 175.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 41.5 m -63.16 -58.15 17.45 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.42 -39.11 92.83 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 123.486 2.791 . . . . 0.0 112.469 169.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 68.9 t -60.74 -43.69 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 120.059 -1.651 . . . . 0.0 111.478 176.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.18 -40.01 86.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.461 -0.78 . . . . 0.0 111.554 -175.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . . . . . . . . 0.276 0.0 OUTLIER -74.61 -42.52 58.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 116.674 -1.631 . . . . 0.0 111.021 175.042 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.497 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -65.84 -22.5 66.55 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 122.353 2.342 . . . . 0.0 114.15 176.907 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 3.9 ttp -76.3 -49.45 16.93 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.387 1.075 . . . . 0.0 111.263 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.38 -32.92 73.34 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.649 0.779 . . . . 0.0 112.293 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -96.78 2.39 51.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.887 1.675 . . . . 0.0 113.82 170.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 38.0 58.1 1.5 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 126.47 1.908 . . . . 0.0 114.596 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 55.24 12.63 0.71 Allowed 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.9 t -64.7 157.25 27.86 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -169.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.4 p -86.42 157.22 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.675 1.19 . . . . 0.0 108.209 168.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . 0.297 0.5 OUTLIER -101.59 10.27 40.39 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -168.282 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 37.72 54.03 1.5 Allowed 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 126.99 2.116 . . . . 0.0 115.469 168.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.25 -4.96 82.29 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.884 1.706 . . . . 0.0 116.02 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.62 170.0 54.57 Favored Glycine 0 CA--C 1.536 1.39 0 CA-C-N 119.248 1.524 . . . . 0.0 114.155 174.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.79 -12.57 8.81 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.062 1.345 . . . . 0.0 114.12 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 2.7 p -77.16 32.44 0.15 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.964 1.706 . . . . 0.0 115.138 -172.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.03 -16.22 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.045 1.338 . . . . 0.0 112.407 168.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.27 152.86 4.19 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.248 1.419 . . . . 0.0 110.606 167.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.61 83.57 0.61 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 122.593 1.187 . . . . 0.0 110.499 170.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -62.58 162.53 10.33 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.658 2.383 . . . . 0.0 111.121 169.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.33 -26.01 66.28 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.035 -1.041 . . . . 0.0 113.606 -170.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 96.7 m -63.61 -49.24 74.08 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.682 0.674 . . . . 0.0 110.571 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -66.56 -41.47 88.56 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.381 -0.824 . . . . 0.0 112.072 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 97.6 mt -57.17 -30.58 64.61 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.272 0.942 . . . . 0.0 112.584 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 43.7 m -79.21 -36.73 39.67 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.695 0.798 . . . . 0.0 111.77 173.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -83.46 -29.74 27.78 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.67 -44.79 91.06 Favored Pre-proline 0 CA--C 1.553 1.069 0 CA-C-N 120.53 1.514 . . . . 0.0 112.526 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.95 -34.79 10.12 Favored 'Trans proline' 0 C--N 1.352 0.755 0 CA-C-N 122.363 1.88 . . . . 0.0 113.561 171.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -65.6 -33.6 76.27 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.392 -1.442 . . . . 0.0 113.562 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.03 -28.59 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.562 0.619 . . . . 0.0 111.792 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.7 mt -71.31 -48.22 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.5 171.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -54.92 -44.89 74.63 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.15 0.98 . . . . 0.0 111.66 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.57 -32.58 74.25 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.436 -0.79 . . . . 0.0 112.383 -178.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.77 -47.1 61.35 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.443 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.79 -29.98 67.42 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.568 1.531 . . . . 0.0 114.512 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 24.6 pttt -78.69 -23.59 45.51 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -134.64 73.22 68.05 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 125.017 1.327 . . . . 0.0 111.91 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -61.04 -12.71 23.93 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.705 2.937 . . . . 0.0 117.208 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -80.3 -21.52 42.52 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.587 1.155 . . . . 0.0 113.22 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -63.56 152.73 37.87 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.766 0.827 . . . . 0.0 111.795 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -85.97 132.17 34.13 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 66.8 tp -49.8 -43.51 48.58 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -168.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -75.93 -7.9 55.67 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.852 -1.155 . . . . 0.0 113.982 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 58.8 p -57.54 -25.98 60.72 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.343 -1.473 . . . . 0.0 111.38 168.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -70.76 -1.99 13.27 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.794 1.237 . . . . 0.0 113.914 177.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -32.44 50.87 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.65 1.18 . . . . 0.0 111.611 166.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -66.31 -28.5 68.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.506 1.122 . . . . 0.0 112.887 -168.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -73.56 -30.07 62.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.693 1.997 . . . . 0.0 115.757 169.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -94.73 123.56 38.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.491 1.116 . . . . 0.0 113.856 -167.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 27.6 m -103.69 -2.62 26.24 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -87.48 8.63 23.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -81.99 41.28 0.66 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.663 1.985 . . . . 0.0 114.413 -173.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.71 158.48 29.34 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 127.28 2.232 . . . . 0.0 111.918 -178.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -65.77 154.77 72.46 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.64 2.227 . . . . 0.0 112.401 169.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 . . . . . 0 C--O 1.253 1.287 0 C-N-CA 125.769 1.628 . . . . 0.0 112.31 179.538 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.294 0.2 OUTLIER 69.51 35.63 2.45 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.744 1.617 . . . . 0.0 114.511 172.683 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -76.5 164.19 26.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.181 2.592 . . . . 0.0 106.08 164.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.1 t -105.06 108.89 20.65 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 120.765 -1.209 . . . . 0.0 112.66 -166.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.27 -29.8 71.06 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.796 -1.19 . . . . 0.0 111.209 170.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 mtmt -60.25 -44.62 95.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.527 1.131 . . . . 0.0 112.281 175.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -99.33 15.02 27.59 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.807 1.243 . . . . 0.0 113.982 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 57.2 ttm -60.78 126.14 26.3 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -78.57 154.75 30.1 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.288 -1.508 . . . . 0.0 110.491 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.51 -34.0 74.76 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.314 -1.491 . . . . 0.0 112.968 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -62.1 -31.61 72.09 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.791 0.836 . . . . 0.0 113.251 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -80.49 -36.03 33.93 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.402 1.481 . . . . 0.0 111.348 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -59.86 -48.85 80.01 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.354 -0.841 . . . . 0.0 111.981 175.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.0 pt -71.51 -2.11 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 125.056 1.342 . . . . 0.0 113.246 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.64 -13.02 16.11 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.343 1.457 . . . . 0.0 113.155 170.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.82 158.6 35.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.313 1.045 . . . . 0.0 111.31 175.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -64.65 139.7 97.83 Favored Pre-proline 0 N--CA 1.48 1.026 0 C-N-CA 123.719 0.808 . . . . 0.0 112.443 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . 0.284 12.1 Cg_exo -78.39 -9.7 16.21 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 CA-C-N 120.809 1.325 . . . . 0.0 114.31 -174.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.6 mttp -66.54 -54.22 26.11 Favored 'General case' 0 C--N 1.356 0.867 0 CA-C-N 120.338 1.426 . . . . 0.0 107.521 166.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.16 -5.92 55.32 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.5 mtt -58.64 -51.84 68.23 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.351 0.978 . . . . 0.0 111.821 170.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.3 m -54.53 -49.82 88.85 Favored Pre-proline 0 N--CA 1.482 1.159 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -173.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.5 -45.95 37.29 Favored 'Trans proline' 0 N--CA 1.476 0.489 0 C-N-CA 123.227 2.618 . . . . 0.0 116.47 170.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.31 -41.28 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 120.841 -1.162 . . . . 0.0 112.469 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.26 -27.96 67.68 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.371 1.068 . . . . 0.0 111.125 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 57.6 t90 -82.0 -51.13 8.35 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-O 117.189 -1.386 . . . . 0.0 113.103 170.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.9 t90 -62.96 -31.43 72.53 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 120.652 1.569 . . . . 0.0 110.797 -168.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 62.4 ttp -57.68 -51.88 67.73 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.041 1.336 . . . . 0.0 112.12 167.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.49 -28.84 68.88 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.374 1.47 . . . . 0.0 113.887 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -114.07 -26.86 7.9 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -173.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 67.28 142.28 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 128.826 2.851 . . . . 0.0 117.373 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -72.73 -16.66 61.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.312 1.445 . . . . 0.0 113.504 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 66.2 p -71.62 29.25 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 128.556 2.742 . . . . 0.0 116.524 -168.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.0 t 67.96 138.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 128.629 2.772 . . . . 0.0 114.194 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -90.11 17.98 6.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.531 1.532 . . . . 0.0 114.509 -169.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.323 0.2 OUTLIER 39.29 45.92 1.23 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 128.306 2.642 . . . . 0.0 114.793 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.37 5.0 89.96 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.726 1.631 . . . . 0.0 115.611 174.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.01 166.44 54.72 Favored Glycine 0 CA--C 1.535 1.303 0 CA-C-N 118.661 1.23 . . . . 0.0 114.263 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -115.99 -177.39 3.15 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.502 1.521 . . . . 0.0 112.271 172.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.3 m 58.22 41.11 24.06 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 122.765 1.269 . . . . 0.0 111.4 -169.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.2 m -66.27 -7.61 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.14 0.976 . . . . 0.0 112.364 168.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.39 147.8 5.59 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.92 2.088 . . . . 0.0 111.956 170.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.409 HD23 ' CD1' ' A' ' 26' ' ' TRP . 2.3 tm? -62.19 115.66 4.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 167.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -120.9 177.08 5.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.451 1.1 . . . . 0.0 113.245 -168.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -67.72 -21.38 65.3 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.762 -1.211 . . . . 0.0 114.089 -171.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -67.45 -42.86 82.38 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.2 0.909 . . . . 0.0 110.279 169.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -62.53 -47.84 82.13 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.641 -0.662 . . . . 0.0 110.697 173.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 81.6 mt -63.56 -26.05 68.52 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.058 -1.026 . . . . 0.0 112.501 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.3 m -75.27 -38.75 60.32 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.015 0.526 . . . . 0.0 110.958 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -86.91 -27.91 23.09 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.041 -0.981 . . . . 0.0 113.628 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.6 mp -51.78 -43.63 88.83 Favored Pre-proline 0 CA--C 1.551 0.998 0 CA-C-N 120.641 1.564 . . . . 0.0 113.005 175.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.21 -39.56 7.4 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 122.054 1.769 . . . . 0.0 113.555 169.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.64 -37.52 87.65 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.431 1.014 . . . . 0.0 112.909 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.49 -26.23 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 177.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.6 mt -73.74 -52.47 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 121.776 -0.578 . . . . 0.0 110.195 173.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -55.45 -49.27 72.89 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.611 0.765 . . . . 0.0 110.502 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -65.45 -25.51 67.55 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.514 -0.741 . . . . 0.0 112.019 -176.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.67 -47.98 15.91 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.125 0.875 . . . . 0.0 112.295 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -26.68 68.4 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.662 1.574 . . . . 0.0 113.748 174.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 mtpp -72.75 -29.03 62.99 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.778 1.631 . . . . 0.0 114.492 169.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -135.04 66.79 68.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.138 1.375 . . . . 0.0 112.397 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -57.65 -13.55 14.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 123.514 2.809 . . . . 0.0 116.914 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -83.97 -21.06 31.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.226 1.41 . . . . 0.0 113.762 -178.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -69.06 156.0 39.39 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.928 0.891 . . . . 0.0 111.775 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -92.84 122.75 35.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.7 tp -42.69 -52.9 4.74 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -165.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -68.32 -8.11 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -173.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -55.69 -28.16 54.12 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 121.021 -1.049 . . . . 0.0 111.294 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -71.99 -1.22 13.77 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.642 1.577 . . . . 0.0 114.336 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -31.61 25.89 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.183 1.356 . . . . 0.0 110.936 166.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.53 -26.65 64.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.937 0.895 . . . . 0.0 111.909 -170.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -72.97 -28.99 62.73 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.553 1.541 . . . . 0.0 114.937 171.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.32 103.82 14.8 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.165 1.386 . . . . 0.0 113.78 -167.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 51.0 m -78.84 79.94 5.22 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.477 1.111 . . . . 0.0 110.685 171.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -70.67 172.28 8.94 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.68 1.192 . . . . 0.0 112.314 -176.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -74.5 29.12 0.08 Allowed 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.75 2.13 . . . . 0.0 116.75 -168.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.07 152.9 79.81 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 125.13 1.372 . . . . 0.0 112.395 173.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.56 162.57 42.01 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.995 2.463 . . . . 0.0 112.139 170.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.343 0 C-N-CA 125.786 1.634 . . . . 0.0 112.175 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.332 10.4 t-20 72.59 26.21 2.52 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.735 1.614 . . . . 0.0 114.753 176.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.25 159.18 32.82 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.779 2.431 . . . . 0.0 105.376 163.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.1 t -105.38 103.51 13.05 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 120.264 -1.523 . . . . 0.0 113.746 -164.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.21 -35.68 67.59 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.758 -1.214 . . . . 0.0 110.275 170.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -66.53 -20.61 66.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.398 2.279 . . . . 0.0 115.512 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -123.65 9.4 8.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.628 1.171 . . . . 0.0 113.213 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 27.9 ttm -61.4 134.04 56.47 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 120.552 -1.342 . . . . 0.0 109.858 169.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 9.3 p -71.81 169.85 14.88 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 121.948 0.88 . . . . 0.0 112.381 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.2 m -70.37 -38.68 74.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.933 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -63.78 -37.73 88.45 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.416 1.007 . . . . 0.0 112.37 173.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -73.12 -39.03 66.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.483 1.113 . . . . 0.0 111.598 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -61.5 -49.46 76.66 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.431 -0.793 . . . . 0.0 113.105 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.3 pt -68.41 -4.72 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 176.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -105.9 -10.75 16.48 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.282 1.833 . . . . 0.0 114.058 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 158.84 34.72 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.767 1.167 . . . . 0.0 110.887 176.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -58.11 134.21 84.18 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.186 0.995 . . . . 0.0 113.164 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.95 -16.86 32.49 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 122.693 2.262 . . . . 0.0 115.686 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -63.7 -49.23 73.93 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 121.003 1.729 . . . . 0.0 109.716 170.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.38 -16.03 38.58 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.4 ttm -54.6 -34.86 62.68 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.462 -1.399 . . . . 0.0 113.236 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 56.3 m -65.58 -57.38 14.61 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-O 117.535 -1.222 . . . . 0.0 112.911 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -52.79 -38.72 78.25 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.881 3.054 . . . . 0.0 114.444 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 58.4 t -62.83 -52.61 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 121.9 -0.5 . . . . 0.0 111.286 176.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.94 -40.99 95.37 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.291 1.037 . . . . 0.0 110.842 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 82.5 t90 -68.19 -50.04 56.89 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.577 -1.201 . . . . 0.0 112.626 175.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.414 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.2 t90 -67.77 -29.91 69.23 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 120.746 1.612 . . . . 0.0 111.56 -168.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.8 tmm? -60.41 -48.5 81.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.578 1.151 . . . . 0.0 111.577 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.9 -24.84 60.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.89 1.276 . . . . 0.0 113.18 -178.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -136.8 85.6 2.15 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.949 1.699 . . . . 0.0 109.652 -177.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -48.67 154.69 0.65 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.282 2.233 . . . . 0.0 117.008 -169.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -71.27 1.25 6.35 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.335 2.254 . . . . 0.0 115.519 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 t -71.23 171.54 10.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.417 1.487 . . . . 0.0 112.607 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.18 141.34 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.413 1.085 . . . . 0.0 111.758 -178.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -81.35 172.86 13.06 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.967 0.907 . . . . 0.0 113.022 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.72 138.19 50.99 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.749 1.62 . . . . 0.0 109.976 169.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.66 -3.22 44.05 Favored Glycine 0 CA--C 1.542 1.774 0 N-CA-C 117.106 1.602 . . . . 0.0 117.106 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -171.72 -169.3 34.4 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-N 119.936 1.868 . . . . 0.0 115.318 178.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -133.68 32.84 3.54 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 126.766 2.026 . . . . 0.0 113.406 -169.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 22.4 p -74.32 60.37 0.83 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 127.068 2.147 . . . . 0.0 115.32 -168.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 35.7 m -69.26 -8.9 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.434 1.094 . . . . 0.0 112.171 167.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.9 153.68 8.27 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 129.569 3.148 . . . . 0.0 114.024 171.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -74.13 127.18 32.27 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.621 0.768 . . . . 0.0 109.968 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -91.22 161.12 15.19 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.568 1.147 . . . . 0.0 109.974 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.99 -26.93 68.79 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.419 -1.425 . . . . 0.0 112.001 174.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 32.9 m -60.83 -42.21 97.29 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.222 1.009 . . . . 0.0 111.107 168.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -66.31 -50.02 65.06 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.196 0.907 . . . . 0.0 110.732 174.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -56.01 -32.61 64.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.748 0.819 . . . . 0.0 112.265 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 26.1 m -80.86 -38.53 27.98 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.648 0.779 . . . . 0.0 112.287 173.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -78.0 -31.83 50.84 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 117.321 -1.324 . . . . 0.0 114.452 -175.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.51 -46.37 90.55 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 121.2 1.818 . . . . 0.0 112.998 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.25 -38.54 8.77 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 121.941 1.729 . . . . 0.0 113.428 172.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -67.54 -31.73 72.02 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.746 -1.221 . . . . 0.0 113.773 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.3 -26.86 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 118.384 0.538 . . . . 0.0 111.994 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 39.7 mt -71.0 -50.18 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.701 0.8 . . . . 0.0 109.715 171.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.93 -45.48 82.7 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.759 0.824 . . . . 0.0 111.813 175.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.88 -24.87 65.28 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.653 -1.279 . . . . 0.0 112.299 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.9 -46.94 19.89 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.916 0.78 . . . . 0.0 112.207 176.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -26.19 68.04 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 120.363 1.438 . . . . 0.0 113.981 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -68.92 -31.1 69.77 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 168.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -133.05 63.83 68.27 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 124.872 1.269 . . . . 0.0 112.322 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -56.9 -20.03 34.43 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.166 2.578 . . . . 0.0 116.435 -171.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -80.2 -16.77 54.07 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.605 1.162 . . . . 0.0 113.283 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' B' ' 143' ' ' LYS . 10.0 mmpt? -74.25 165.89 24.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.612 1.165 . . . . 0.0 112.219 -172.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -80.46 151.57 29.21 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 49.2 tp -68.56 -38.97 81.21 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.2 -20.16 30.59 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -169.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.8 t -62.06 -16.47 52.23 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.048 -1.033 . . . . 0.0 112.127 171.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.5 -4.04 5.31 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 119.512 -1.992 . . . . 0.0 114.336 168.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.13 -28.35 35.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.293 1.437 . . . . 0.0 111.988 166.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.17 -35.47 81.19 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.175 1.39 . . . . 0.0 112.075 -174.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -70.78 -28.22 64.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.348 1.859 . . . . 0.0 114.948 173.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.95 102.66 12.74 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -167.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.1 m -79.03 70.43 5.37 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.574 1.15 . . . . 0.0 110.542 169.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.91 165.12 16.07 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.056 1.343 . . . . 0.0 112.422 -177.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -70.29 138.72 51.79 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -171.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.8 mp -133.03 150.53 75.83 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.876 1.67 . . . . 0.0 109.219 168.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -65.87 165.38 23.76 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.596 2.197 . . . . 0.0 114.659 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 127.012 2.125 . . . . 0.0 113.951 178.483 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.975 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.257 8.4 t-20 60.0 40.43 18.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.902 1.681 . . . . 0.0 115.096 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -62.18 -24.53 67.25 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.243 1.017 . . . . 0.0 112.681 168.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 93.75 104.4 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.982 2.913 . . . . 0.0 117.45 167.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.49 -29.06 68.83 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 119.855 -1.778 . . . . 0.0 112.306 169.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.431 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 7.7 mtmt -65.28 -30.85 71.75 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.145 1.378 . . . . 0.0 114.118 174.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -100.8 4.95 43.32 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.479 1.111 . . . . 0.0 113.077 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.9 ttm -63.89 139.83 58.81 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 119.604 1.093 . . . . 0.0 110.487 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.3 p -78.44 175.88 9.89 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.038 -1.038 . . . . 0.0 112.247 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.31 -39.72 53.36 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.702 171.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.78 -35.96 79.69 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.11 0.868 . . . . 0.0 112.23 171.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -75.72 -38.55 58.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.66 1.184 . . . . 0.0 111.948 176.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -57.5 -50.58 72.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 121.478 -0.764 . . . . 0.0 112.792 176.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.9 pt -68.26 -4.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 C-N-CA 124.094 0.958 . . . . 0.0 112.519 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -106.98 -13.61 15.16 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.337 1.455 . . . . 0.0 114.291 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.73 163.77 27.18 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 120.892 -1.13 . . . . 0.0 111.048 173.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 t-20 -65.07 131.52 95.19 Favored Pre-proline 0 N--CA 1.484 1.23 0 O-C-N 120.683 -1.261 . . . . 0.0 112.531 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.94 -16.16 37.08 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.82 3.014 . . . . 0.0 115.669 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.9 mptt -58.17 -65.49 0.64 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 125.776 1.631 . . . . 0.0 108.899 167.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.02 -9.61 59.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -177.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 83.7 mtp -58.1 -35.97 72.2 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.797 1.181 . . . . 0.0 112.749 171.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.5 m -64.19 -55.95 27.56 Favored Pre-proline 0 N--CA 1.484 1.236 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.23 -35.31 95.39 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.325 2.683 . . . . 0.0 114.224 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.1 t -63.1 -52.36 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.392 0.677 . . . . 0.0 111.617 173.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.97 -39.32 91.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.045 1.338 . . . . 0.0 110.708 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 72.4 t90 -67.74 -51.86 44.3 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-O 116.944 -1.503 . . . . 0.0 112.644 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.455 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.4 t90 -67.28 -25.05 65.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.973 1.715 . . . . 0.0 111.7 -169.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -67.66 -46.19 73.1 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.448 1.099 . . . . 0.0 111.702 169.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -41.21 98.39 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -110.84 90.6 3.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.712 1.205 . . . . 0.0 112.161 172.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -65.19 144.93 56.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.501 1.92 . . . . 0.0 113.862 -169.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.67 3.76 2.3 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.7 t -75.24 30.47 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.897 2.079 . . . . 0.0 114.861 -170.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.8 t 62.78 128.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 128.933 2.893 . . . . 0.0 113.788 -171.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 170.11 17.09 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.927 1.291 . . . . 0.0 112.19 -178.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 138.03 49.65 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.942 1.297 . . . . 0.0 110.137 173.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.03 -43.65 0.52 Allowed Glycine 0 CA--C 1.542 1.72 0 C-N-CA 125.606 1.575 . . . . 0.0 114.653 -171.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 92.5 -171.11 33.16 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.525 1.536 . . . . 0.0 113.848 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.1 t70 62.11 -44.69 0.17 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 128.502 2.721 . . . . 0.0 117.315 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 m -71.28 6.14 1.87 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.394 1.478 . . . . 0.0 114.744 -171.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.4 m -58.89 -10.77 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.26 1.824 . . . . 0.0 112.954 168.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 p -50.15 161.12 0.3 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.859 2.063 . . . . 0.0 113.48 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.7 mt -78.71 92.69 4.81 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.303 -0.873 . . . . 0.0 108.724 167.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -71.75 164.92 25.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.33 1.052 . . . . 0.0 109.717 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.19 -28.08 69.14 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.033 -1.667 . . . . 0.0 112.685 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 m -63.48 -42.31 98.57 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.384 -0.823 . . . . 0.0 110.84 168.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -67.28 -42.45 83.76 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.963 -1.086 . . . . 0.0 110.584 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.57 -26.89 68.82 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.316 -0.865 . . . . 0.0 111.794 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.4 m -77.91 -36.21 49.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.221 1.008 . . . . 0.0 111.502 171.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.99 -28.97 29.33 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.31 -39.69 73.61 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-O 117.176 -1.392 . . . . 0.0 112.78 177.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -73.98 -37.94 2.51 Favored 'Trans proline' 0 C--N 1.354 0.825 0 CA-C-N 122.307 1.859 . . . . 0.0 113.317 168.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -66.46 -32.41 73.75 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.486 -1.383 . . . . 0.0 113.683 -176.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.62 -17.31 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 11.3 mt -83.45 -52.82 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.416 1.087 . . . . 0.0 109.633 172.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -56.41 -49.9 73.19 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.027 0.931 . . . . 0.0 110.735 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -62.34 -24.77 67.53 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.438 -0.789 . . . . 0.0 111.596 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.73 -47.39 14.03 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.397 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -27.87 69.58 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.848 1.658 . . . . 0.0 113.696 172.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -73.02 -30.52 63.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.787 1.635 . . . . 0.0 115.115 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -131.59 66.62 78.64 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.227 1.411 . . . . 0.0 110.479 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -60.57 -14.36 30.5 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.592 2.861 . . . . 0.0 114.646 -174.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -79.12 -26.29 42.88 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.158 1.783 . . . . 0.0 112.685 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -69.17 162.71 26.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.65 1.18 . . . . 0.0 112.624 -169.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -94.82 131.4 40.74 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.2 tp -52.29 -35.81 51.28 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -166.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.267 5.0 m-85 -82.55 -5.45 58.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.351 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 60.5 p -60.49 -27.81 67.87 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 120.168 -1.583 . . . . 0.0 111.357 168.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -70.6 -4.11 21.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.512 1.525 . . . . 0.0 114.114 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -32.2 40.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.994 1.717 . . . . 0.0 111.316 169.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -72.7 -25.45 61.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.089 1.356 . . . . 0.0 112.176 -171.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -76.19 -31.59 58.55 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.14 -49.9 5.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -167.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 45.3 m 46.2 32.97 1.61 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -85.92 2.42 46.13 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.134 1.374 . . . . 0.0 114.346 -173.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -94.06 53.32 1.74 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.404 1.882 . . . . 0.0 114.993 -166.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.31 160.02 28.5 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.433 1.893 . . . . 0.0 111.462 172.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -61.96 143.71 95.64 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.004 2.47 . . . . 0.0 112.081 168.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.927 1.291 . . . . 0.0 113.003 175.913 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.956 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.307 0.3 OUTLIER 69.03 34.99 2.92 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 171.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -76.01 157.39 33.08 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 163.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 21.0 t -94.26 99.51 11.74 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 120.672 -1.268 . . . . 0.0 113.689 -166.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.32 -33.6 63.45 Favored 'General case' 0 CA--C 1.554 1.123 0 O-C-N 120.827 -1.17 . . . . 0.0 110.911 169.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.431 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 13.5 mtmt -62.54 -37.77 87.41 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.679 1.992 . . . . 0.0 114.199 176.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -106.63 12.82 28.91 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.927 1.291 . . . . 0.0 112.672 -178.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 60.2 ttm -58.48 132.17 52.93 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 121.108 -0.995 . . . . 0.0 108.5 169.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 11.7 p -74.56 172.35 12.17 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.218 -0.926 . . . . 0.0 111.765 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.58 -36.22 73.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.94 170.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -63.67 -35.89 82.05 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.361 0.982 . . . . 0.0 112.462 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.01 -34.75 50.53 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.921 1.288 . . . . 0.0 111.885 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -68.7 -37.13 79.29 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.964 -1.085 . . . . 0.0 113.52 173.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.4 pt -77.64 3.8 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 O-C-N 120.844 -1.16 . . . . 0.0 112.026 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -120.03 -32.24 4.24 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -177.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.42 162.81 14.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.231 1.832 . . . . 0.0 111.906 172.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . 0.427 HD22 ' CD ' ' B' ' 98' ' ' LYS . 48.5 t-20 -63.69 132.22 95.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.805 -168.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.0 -22.22 29.92 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.029 3.153 . . . . 0.0 115.378 176.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.427 ' CD ' HD22 ' B' ' 96' ' ' ASN . 14.6 mttt -56.64 -59.83 4.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.125 1.77 . . . . 0.0 109.365 167.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.75 -14.74 47.35 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 30.5 ttm -53.92 -36.18 62.48 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.947 0.899 . . . . 0.0 111.197 168.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 28.4 m -65.97 -57.65 13.01 Favored Pre-proline 0 N--CA 1.479 0.986 0 CA-C-O 117.862 -1.066 . . . . 0.0 112.818 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -51.23 -41.79 56.68 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.983 3.122 . . . . 0.0 115.188 170.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.92 -37.8 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.606 1.094 . . . . 0.0 113.289 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.16 -33.91 76.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.234 0.613 . . . . 0.0 111.047 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 84.6 t90 -75.91 -50.38 15.17 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-O 117.722 -1.132 . . . . 0.0 112.349 175.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.436 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 1.5 t90 -67.06 -25.51 66.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 117.924 -1.51 . . . . 0.0 111.16 -170.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 54.9 ttp -60.97 -53.36 58.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.638 1.175 . . . . 0.0 111.319 168.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.66 -31.64 66.5 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.775 1.23 . . . . 0.0 112.411 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -124.12 70.7 1.1 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.452 1.501 . . . . 0.0 112.295 175.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . 0.404 ' HG2' ' H ' ' B' ' 111' ' ' GLU . 2.8 tt0 -70.36 -172.44 0.59 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -172.021 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . 0.404 ' H ' ' HG2' ' B' ' 110' ' ' GLU . 28.1 tt0 68.26 -2.25 1.6 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.826 2.05 . . . . 0.0 114.942 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 9.4 p 58.18 13.06 2.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 126.228 1.811 . . . . 0.0 114.621 -170.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 49.1 t -124.53 141.68 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 126.378 1.871 . . . . 0.0 110.217 -169.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -126.36 117.88 23.89 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.725 1.21 . . . . 0.0 110.55 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -123.5 -7.57 8.06 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -169.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -82.72 -12.0 80.74 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 124.261 0.934 . . . . 0.0 114.225 174.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 171.05 -147.8 10.7 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.893 1.711 . . . . 0.0 111.758 -178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 47.0 p-10 -132.86 22.88 4.22 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.32 1.448 . . . . 0.0 112.889 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 20.5 p -76.27 -62.77 1.5 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.561 1.145 . . . . 0.0 113.526 -171.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 24.3 m 41.13 39.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 125.835 1.654 . . . . 0.0 113.539 -172.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.51 -21.03 61.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 128.52 2.728 . . . . 0.0 116.264 -169.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 63.51 71.71 0.49 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.36 1.464 . . . . 0.0 108.762 -167.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 43.1 p30 -76.7 176.38 8.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.997 1.319 . . . . 0.0 113.12 -170.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.29 -25.07 66.68 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.794 -1.191 . . . . 0.0 112.96 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.9 m -66.87 -42.52 85.49 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.274 -0.892 . . . . 0.0 110.909 170.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -64.03 -46.34 84.85 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.973 1.26 . . . . 0.0 111.288 173.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.9 mt -57.17 -27.13 61.64 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.756 0.707 . . . . 0.0 112.624 174.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.4 m -81.08 -37.84 28.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.492 1.117 . . . . 0.0 111.783 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -84.47 -29.95 25.64 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.895 1.442 . . . . 0.0 114.895 -175.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.15 -44.51 98.6 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 120.489 1.495 . . . . 0.0 112.111 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.27 -35.64 18.34 Favored 'Trans proline' 0 C--N 1.353 0.781 0 CA-C-N 122.205 1.823 . . . . 0.0 113.718 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.76 -38.66 91.45 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.453 1.479 . . . . 0.0 112.869 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 m -69.09 -29.19 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.41 -52.15 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.08 0.952 . . . . 0.0 109.9 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -58.19 -42.83 86.97 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.814 0.846 . . . . 0.0 112.386 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -68.32 -27.64 66.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.809 0.844 . . . . 0.0 112.454 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.46 -48.92 15.93 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.364 -0.835 . . . . 0.0 112.906 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -24.93 66.06 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -75.42 -23.36 56.99 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 170.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -138.6 71.95 43.59 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.603 1.161 . . . . 0.0 111.997 172.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -59.14 -16.96 36.14 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.615 2.877 . . . . 0.0 116.772 -172.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -78.33 -16.98 57.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.596 1.158 . . . . 0.0 113.32 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -71.91 164.96 25.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.017 1.327 . . . . 0.0 111.717 -174.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -80.7 159.18 25.34 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 110.366 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.58 -64.82 0.91 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.775 -0.578 . . . . 0.0 112.395 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.431 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 2.7 m-85 -62.49 -21.3 65.38 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -167.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.8 t -55.87 -26.17 45.75 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.477 -0.764 . . . . 0.0 112.31 171.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -64.71 -2.29 2.39 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.823 -1.798 . . . . 0.0 113.748 173.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -72.28 -34.74 68.42 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.668 1.122 . . . . 0.0 111.839 165.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.52 -32.95 73.01 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -167.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -73.55 -28.02 61.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.127 2.171 . . . . 0.0 115.706 175.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -111.48 100.37 8.95 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -165.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 44.2 p -96.32 45.39 1.07 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.06 1.744 . . . . 0.0 114.591 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -68.26 120.07 13.82 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.594 -1.316 . . . . 0.0 112.933 -176.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.7 t70 58.18 -64.41 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.161 2.984 . . . . 0.0 116.814 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.18 153.27 94.41 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.941 1.296 . . . . 0.0 112.277 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.99 142.76 57.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.449 2.099 . . . . 0.0 111.523 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 56.6 t30 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 126.306 1.842 . . . . 0.0 113.08 -173.535 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.924 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.382 13.5 t-20 75.91 51.8 0.06 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 127.345 2.258 . . . . 0.0 112.759 -174.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 pm0 -64.33 -161.35 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.828 1 C-N-CA 132.942 4.497 . . . . 0.0 112.037 166.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.484 ' H ' ' HG3' ' B' ' 98' ' ' LYS . 26.8 t -148.4 88.5 1.64 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 113.853 -1.522 . . . . 0.0 109.335 167.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.69 -31.74 66.67 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.653 -1.279 . . . . 0.0 110.74 171.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.435 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 8.9 mttt -50.12 -49.55 51.44 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.602 1.961 . . . . 0.0 111.728 170.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -100.71 16.43 24.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.287 1.435 . . . . 0.0 113.842 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -55.83 124.13 16.52 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 167.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.5 t -75.48 153.12 37.73 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 120.9 -1.125 . . . . 0.0 110.141 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.23 -32.7 73.41 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.063 -1.648 . . . . 0.0 112.935 -175.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -64.93 -31.0 72.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.91 0.884 . . . . 0.0 112.606 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -77.96 -37.7 46.88 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.193 1.397 . . . . 0.0 111.556 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.98 -49.41 77.77 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.455 -0.778 . . . . 0.0 112.885 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.3 pt -68.42 -5.79 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.669 1.188 . . . . 0.0 113.152 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -110.6 -8.45 14.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.811 1.644 . . . . 0.0 113.74 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.92 159.54 32.65 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 121.057 -1.027 . . . . 0.0 110.329 175.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -65.43 128.65 93.98 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 121.19 -0.944 . . . . 0.0 111.837 -173.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.62 -15.56 12.66 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.777 2.985 . . . . 0.0 115.567 178.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -62.5 -72.41 0.13 Allowed 'General case' 0 C--N 1.349 0.557 0 C-N-CA 126.423 1.889 . . . . 0.0 109.463 166.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.51 -4.11 43.95 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -177.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.9 ttt -58.18 -39.95 80.22 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 112.92 170.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.263 20.1 m -66.21 -51.39 44.85 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -50.16 -45.12 34.92 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.453 2.768 . . . . 0.0 115.841 169.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 p -73.69 -39.0 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.204 0.911 . . . . 0.0 113.358 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.72 -26.3 68.61 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.197 0.999 . . . . 0.0 111.676 172.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 65.5 t90 -83.61 -51.78 7.01 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.378 171.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.453 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.9 t90 -66.02 -34.85 79.03 Favored 'General case' 0 C--N 1.348 0.521 0 CA-C-N 120.329 1.422 . . . . 0.0 112.026 -167.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -55.85 -38.82 70.58 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.694 1.198 . . . . 0.0 112.168 171.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -36.95 68.1 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.257 1.423 . . . . 0.0 112.853 -169.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -91.47 -32.07 15.73 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.044 0.937 . . . . 0.0 113.038 169.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.8 tt0 73.1 153.97 0.14 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 129.013 2.925 . . . . 0.0 114.036 -169.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 11.48 0.22 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.2 t -64.09 -9.81 18.65 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.295 2.238 . . . . 0.0 114.151 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.452 ' O ' ' HE3' ' A' ' 36' ' ' LYS 0.278 0.4 OUTLIER 76.61 160.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 127.856 2.463 . . . . 0.0 115.191 -177.459 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -86.94 95.22 9.83 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.266 1.826 . . . . 0.0 109.739 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.452 ' HE3' ' O ' ' A' ' 34' ' ' VAL . 14.7 mmtp -58.24 134.5 56.59 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.594 0.711 . . . . 0.0 112.785 -169.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.79 -6.36 3.74 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.828 1.68 . . . . 0.0 116.093 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.09 155.1 5.54 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.308 1.554 . . . . 0.0 113.424 -172.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -159.41 -176.04 5.56 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.839 1.656 . . . . 0.0 108.092 -175.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -62.64 -31.86 72.79 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.843 -1.161 . . . . 0.0 109.564 164.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t 60.62 70.33 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.467 1.907 . . . . 0.0 112.557 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.5 p -118.33 154.19 32.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.541 1.136 . . . . 0.0 113.103 -177.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -72.13 82.57 0.99 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.586 1.184 . . . . 0.0 110.157 169.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -65.26 164.06 14.13 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.835 2.054 . . . . 0.0 111.739 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.44 -24.35 65.62 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.931 -1.105 . . . . 0.0 113.646 -171.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 m -61.92 -48.77 78.96 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.317 0.962 . . . . 0.0 110.676 169.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -57.81 -49.5 76.43 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.253 0.933 . . . . 0.0 110.385 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.33 -29.29 68.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.591 0.756 . . . . 0.0 112.259 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.7 m -78.74 -34.05 46.1 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.871 1.268 . . . . 0.0 111.857 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -79.14 -26.56 42.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.466 -1.254 . . . . 0.0 113.139 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mm -53.74 -46.13 98.49 Favored Pre-proline 0 N--CA 1.479 0.976 0 CA-C-N 120.327 1.421 . . . . 0.0 112.76 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.22 -37.24 14.57 Favored 'Trans proline' 0 C--N 1.352 0.731 0 CA-C-N 121.701 1.643 . . . . 0.0 113.141 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.88 -37.3 85.76 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.829 -1.169 . . . . 0.0 113.364 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.72 -16.96 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.221 0.608 . . . . 0.0 112.582 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mt -85.12 -49.69 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 124.238 1.015 . . . . 0.0 110.232 171.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -57.47 -39.62 76.76 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.949 0.9 . . . . 0.0 111.758 176.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -71.38 -23.63 61.93 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.19 -0.943 . . . . 0.0 111.67 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -81.09 -44.2 18.34 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.051 -1.031 . . . . 0.0 112.151 175.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -27.4 69.28 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 120.549 1.522 . . . . 0.0 113.698 172.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -71.76 -35.79 70.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -126.98 62.2 50.77 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.876 1.27 . . . . 0.0 111.376 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.96 -17.15 10.28 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.707 3.605 . . . . 0.0 116.071 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -83.28 -22.9 32.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.589 1.555 . . . . 0.0 113.183 -176.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -68.53 159.24 32.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.077 0.951 . . . . 0.0 112.473 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -97.54 118.15 33.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 -175.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -43.24 -43.88 5.01 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -165.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CG ' ' HA ' ' A' ' 6' ' ' LYS 0.251 4.3 m-30 -72.01 -8.23 53.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 120.445 1.475 . . . . 0.0 114.06 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.2 p -58.74 -27.48 64.98 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 120.255 -1.528 . . . . 0.0 111.838 167.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -70.54 -11.67 61.08 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.581 -1.324 . . . . 0.0 112.664 177.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -68.8 -30.68 69.3 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.516 1.127 . . . . 0.0 112.057 169.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -69.41 -16.67 63.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 112.003 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -79.79 -26.37 40.62 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.266 2.226 . . . . 0.0 114.396 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -104.03 -98.16 0.31 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -163.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.1 m 53.2 59.37 4.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 125.48 1.512 . . . . 0.0 111.974 -168.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -59.71 -71.3 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.129 1.372 . . . . 0.0 114.332 -169.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -98.55 -57.42 2.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.484 ' CD1' ' H ' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -79.07 146.57 67.93 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.147 1.779 . . . . 0.0 113.356 -176.42 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -82.9 171.72 11.53 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 124.182 3.255 . . . . 0.0 112.153 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.287 0 C-N-CA 125.499 1.52 . . . . 0.0 111.931 175.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.904 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 52.4 t30 58.05 48.28 13.4 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.98 1.712 . . . . 0.0 114.966 175.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -64.27 -20.54 66.13 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.117 167.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t 102.79 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 129.525 3.13 . . . . 0.0 116.975 166.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.7 -39.73 68.47 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.391 -1.443 . . . . 0.0 111.287 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.437 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 4.4 ptpt -77.08 1.65 17.45 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -127.08 6.84 6.53 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.084 1.354 . . . . 0.0 112.64 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 33.4 ttm -62.2 137.43 58.25 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.778 -1.201 . . . . 0.0 110.046 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 22.2 p -74.18 167.51 21.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.124 0.964 . . . . 0.0 111.727 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.73 -36.28 73.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.826 170.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -63.12 -36.96 85.35 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.161 0.891 . . . . 0.0 112.58 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -75.86 -38.72 57.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.941 0.896 . . . . 0.0 111.874 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -59.94 -45.38 92.81 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.189 -0.944 . . . . 0.0 113.08 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -71.45 -0.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 118.89 0.768 . . . . 0.0 112.665 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -119.03 -14.77 9.33 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 126.331 1.853 . . . . 0.0 114.949 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.64 159.15 13.8 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.956 1.253 . . . . 0.0 111.234 173.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -73.31 130.7 83.96 Favored Pre-proline 0 N--CA 1.482 1.151 0 O-C-N 120.72 -1.238 . . . . 0.0 110.263 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -58.18 -26.93 78.35 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 121.69 1.593 . . . . 0.0 114.445 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.484 ' HG3' ' H ' ' A' ' 4' ' ' SER . 6.5 mptt -56.7 -15.07 3.88 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 121.459 1.936 . . . . 0.0 114.604 175.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -123.38 21.37 9.51 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 122.791 2.541 . . . . 0.0 114.61 167.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 35.7 ttm -73.42 -57.84 3.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.44 1.496 . . . . 0.0 112.503 172.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.6 m -49.58 -52.35 51.11 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.35 -45.26 40.74 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.996 3.13 . . . . 0.0 115.792 172.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.2 p -75.63 -39.84 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 120.749 1.613 . . . . 0.0 112.785 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.82 -31.58 69.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.776 0.83 . . . . 0.0 111.252 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 37.5 t90 -83.06 -47.18 11.95 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.556 -1.211 . . . . 0.0 112.102 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.413 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -68.84 -24.1 64.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 121.208 1.822 . . . . 0.0 111.128 -170.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.09 -46.91 79.14 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.935 1.294 . . . . 0.0 111.51 169.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.33 -24.77 68.0 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.173 1.389 . . . . 0.0 113.187 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -119.31 54.03 1.0 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.091 2.156 . . . . 0.0 111.773 172.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -48.34 128.42 14.43 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 57.72 10.13 1.0 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.464 1.506 . . . . 0.0 114.536 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 53.67 -13.57 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -178.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.78 135.08 24.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 119.423 1.011 . . . . 0.0 111.976 -170.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.19 162.54 28.66 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -166.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -149.81 139.17 21.4 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.683 1.593 . . . . 0.0 111.503 -173.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 63.01 14.22 51.96 Favored Glycine 0 CA--C 1.542 1.731 0 N-CA-C 116.765 1.466 . . . . 0.0 116.765 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 173.19 -163.85 35.55 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.92 1.36 . . . . 0.0 113.952 -174.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -135.92 11.61 3.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.441 1.496 . . . . 0.0 114.863 -171.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 35.4 p -74.8 31.71 0.09 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 -169.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.43 -8.18 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 120.954 -1.091 . . . . 0.0 112.778 168.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.12 147.83 2.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.469 2.308 . . . . 0.0 113.288 173.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 39.7 tp -74.27 70.2 1.63 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.456 1.102 . . . . 0.0 110.028 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 18.8 p30 -72.34 174.0 7.94 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.042 2.137 . . . . 0.0 112.335 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.38 -27.16 65.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -172.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 18.6 m -65.31 -50.98 63.62 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.246 0.93 . . . . 0.0 109.739 169.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -59.46 -48.87 80.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.311 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 76.0 mt -52.82 -34.91 56.03 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.264 1.025 . . . . 0.0 113.009 174.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 58.7 m -75.72 -33.15 60.29 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.375 0.67 . . . . 0.0 111.596 175.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -81.03 -25.1 37.43 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 179.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.1 mm -54.42 -44.35 98.75 Favored Pre-proline 0 CA--C 1.555 1.161 0 CA-C-N 120.187 1.358 . . . . 0.0 112.173 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.98 -34.38 10.59 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.821 1.686 . . . . 0.0 113.204 171.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -66.1 -32.39 73.82 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.659 -1.276 . . . . 0.0 113.604 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.09 -25.9 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.663 0.665 . . . . 0.0 112.481 173.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.5 mt -73.62 -53.06 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.797 0.839 . . . . 0.0 109.546 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.42 -44.21 84.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.935 0.894 . . . . 0.0 112.184 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -71.44 -24.48 62.03 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.99 -1.069 . . . . 0.0 112.172 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.88 -46.01 22.57 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.118 -0.989 . . . . 0.0 112.055 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -26.03 68.59 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 120.28 1.4 . . . . 0.0 113.778 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -72.85 -32.34 65.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 168.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -129.34 60.51 51.62 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.22 1.408 . . . . 0.0 111.11 -175.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -60.17 -17.07 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.747 2.965 . . . . 0.0 115.424 -169.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -80.39 -18.01 50.18 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.668 1.187 . . . . 0.0 113.355 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -71.79 165.97 22.99 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.252 1.021 . . . . 0.0 112.429 -172.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -92.49 130.82 38.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 55.0 tp -46.71 -34.51 5.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.271 1.828 . . . . 0.0 114.092 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.437 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.2 m-85 -84.66 -8.71 58.77 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.6 p -62.81 -25.59 68.32 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.564 -1.335 . . . . 0.0 111.391 168.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -71.5 -2.98 18.7 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.28 1.432 . . . . 0.0 114.204 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -32.17 41.35 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.942 1.297 . . . . 0.0 111.277 167.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -72.44 -31.04 65.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.639 1.176 . . . . 0.0 112.431 -169.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -67.82 -30.0 69.3 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.701 1.6 . . . . 0.0 114.662 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -98.67 -38.55 9.07 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -167.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.9 m 61.42 -37.03 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 127.487 2.315 . . . . 0.0 116.263 -169.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 65.36 -174.17 0.18 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 128.482 2.713 . . . . 0.0 114.911 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -61.43 -34.38 75.3 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 -167.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.0 159.47 84.0 Favored Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.51 127.34 19.62 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 122.719 2.28 . . . . 0.0 110.478 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.201 0 C-N-CA 125.276 1.431 . . . . 0.0 111.878 -169.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 51.3 t30 57.14 46.14 19.5 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.109 1.764 . . . . 0.0 115.118 177.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -61.97 -22.9 66.04 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.411 167.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t 93.42 98.85 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.571 2.748 . . . . 0.0 117.217 165.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.27 -30.33 66.5 Favored 'General case' 0 CA--C 1.556 1.19 0 O-C-N 120.211 -1.556 . . . . 0.0 112.06 172.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.423 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 11.1 mtmt -64.91 -20.51 66.48 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.821 1.649 . . . . 0.0 114.869 173.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -114.5 7.36 16.17 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.035 1.334 . . . . 0.0 113.053 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -63.12 123.93 19.85 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.68 -1.263 . . . . 0.0 109.771 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.62 155.35 29.62 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.156 -0.965 . . . . 0.0 110.379 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -63.5 -33.46 75.64 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 120.247 -1.533 . . . . 0.0 113.291 -174.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.13 -32.99 73.64 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 171.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -78.93 -36.42 41.8 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.123 1.369 . . . . 0.0 111.774 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.09 -49.31 78.17 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.402 -0.811 . . . . 0.0 112.502 177.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -68.51 -2.54 2.03 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 124.743 1.217 . . . . 0.0 112.856 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -113.49 -11.1 13.12 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.872 1.669 . . . . 0.0 113.826 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.23 155.64 38.32 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 121.116 -0.99 . . . . 0.0 110.726 172.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -68.36 132.82 91.35 Favored Pre-proline 0 N--CA 1.48 1.043 0 O-C-N 121.052 -1.03 . . . . 0.0 111.231 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -45.49 -35.42 12.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.304 3.336 . . . . 0.0 114.466 175.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.7 mttt -61.2 -19.06 61.17 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -177.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -127.52 19.53 6.78 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.655 1.57 . . . . 0.0 114.207 166.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 47.6 mtp -65.79 -58.73 4.95 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.784 0.833 . . . . 0.0 111.961 168.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 m -40.96 -55.31 4.86 Favored Pre-proline 0 N--CA 1.494 1.755 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -58.04 -39.43 85.9 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 123.791 2.994 . . . . 0.0 115.806 175.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.8 -38.4 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.807 1.185 . . . . 0.0 112.632 174.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.96 -21.35 66.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.303 1.041 . . . . 0.0 111.573 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.452 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 70.9 t90 -92.36 -49.12 6.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 116.986 -1.483 . . . . 0.0 112.973 168.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -69.27 -22.87 63.79 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 121.744 2.065 . . . . 0.0 112.512 -169.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.0 tmm? -70.76 -34.42 71.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.327 -0.858 . . . . 0.0 111.592 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -42.58 32.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.953 1.701 . . . . 0.0 111.99 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 -119.27 107.51 13.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.967 1.307 . . . . 0.0 107.935 166.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.415 ' C ' ' H ' ' A' ' 33' ' ' THR . 7.2 tt0 -65.16 174.37 2.05 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 121.056 0.455 . . . . 0.0 111.978 176.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.96 13.4 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 174.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.415 ' H ' ' C ' ' A' ' 31' ' ' GLU . 12.6 t -59.53 136.46 57.99 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.447 1.499 . . . . 0.0 111.944 -177.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.5 t -71.64 129.64 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.05 157.85 37.03 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -167.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -142.9 143.67 32.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.836 1.654 . . . . 0.0 111.852 -169.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.48 31.54 Favored Glycine 0 CA--C 1.544 1.905 0 C-N-CA 124.586 1.088 . . . . 0.0 115.466 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.78 -160.75 29.86 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 126.797 2.141 . . . . 0.0 111.01 -172.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -134.31 16.78 3.73 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -169.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 p -76.54 41.93 0.27 Allowed 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -169.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -21.55 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.0 1.32 . . . . 0.0 112.658 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -39.04 141.34 0.31 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.423 2.689 . . . . 0.0 113.695 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 35.1 tp -63.02 99.74 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 168.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -108.78 173.35 6.36 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.371 1.468 . . . . 0.0 112.023 -169.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.38 -26.88 68.2 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.221 -1.549 . . . . 0.0 113.565 -169.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 95.3 m -62.49 -43.18 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.362 -0.836 . . . . 0.0 110.262 168.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.25 -40.58 90.27 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 121.286 -0.884 . . . . 0.0 110.97 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.76 -23.03 66.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.376 0.989 . . . . 0.0 111.433 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.0 m -79.43 -37.3 37.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.055 0.942 . . . . 0.0 111.529 169.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -85.96 -27.06 25.14 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.26 -42.07 89.46 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-N 120.455 1.48 . . . . 0.0 112.385 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.58 -37.79 6.79 Favored 'Trans proline' 0 C--N 1.355 0.911 0 CA-C-N 121.97 1.739 . . . . 0.0 113.186 169.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt -66.81 -32.67 74.1 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.225 -1.547 . . . . 0.0 113.839 -176.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.7 m -69.07 -20.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 119.011 0.823 . . . . 0.0 112.949 173.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.0 mt -83.95 -51.04 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.043 0.937 . . . . 0.0 110.023 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.45 -38.84 78.34 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.152 0.981 . . . . 0.0 111.969 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.94 -30.28 68.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.556 0.616 . . . . 0.0 111.305 177.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -76.62 -42.51 42.02 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 120.934 -1.104 . . . . 0.0 113.072 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.71 -29.62 68.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 120.877 1.671 . . . . 0.0 113.914 177.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG3' HD21 ' A' ' 61' ' ' ASN . 14.3 ptpt -80.11 -29.19 38.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.423 HD21 ' HG3' ' A' ' 60' ' ' LYS . 24.3 m-80 -129.81 70.74 82.13 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.521 1.528 . . . . 0.0 111.121 174.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -59.53 -11.74 15.02 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.859 3.706 . . . . 0.0 116.254 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -83.69 -21.48 32.37 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.355 1.462 . . . . 0.0 113.146 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -69.1 157.4 36.91 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.113 0.965 . . . . 0.0 111.49 -174.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -94.39 134.54 36.78 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.8 tp -51.85 -38.85 57.54 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -168.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.423 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 5.2 m-85 -79.6 -5.88 55.92 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.7 p -61.41 -27.58 68.64 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.043 -1.661 . . . . 0.0 110.948 167.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.41 -2.91 24.28 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.417 1.487 . . . . 0.0 113.487 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -31.48 37.53 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.548 1.539 . . . . 0.0 111.714 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -70.22 -26.66 63.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.742 1.217 . . . . 0.0 112.198 -171.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -79.34 -31.16 42.98 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.763 1.625 . . . . 0.0 115.056 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.79 93.55 4.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.614 1.165 . . . . 0.0 113.602 -167.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.2 m -88.99 39.87 0.95 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.212 1.405 . . . . 0.0 114.768 -171.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -80.67 4.66 18.0 Favored 'General case' 0 CA--C 1.552 1.019 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.59 18.38 0.1 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 116.255 1.946 . . . . 0.0 116.255 -168.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -163.32 153.27 13.15 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 126.057 1.743 . . . . 0.0 112.03 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.8 157.57 60.58 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 122.096 1.864 . . . . 0.0 110.508 165.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.369 1.468 . . . . 0.0 112.835 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.837 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -163.05 118.7 1.77 Allowed 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.707 1.241 . . . . 0.0 108.275 168.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.73 -163.22 0.94 Allowed 'General case' 0 N--CA 1.427 -1.616 0 C-N-CA 129.208 3.003 . . . . 0.0 107.719 -166.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 20.2 m -137.03 56.53 1.79 Allowed 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 124.032 0.933 . . . . 0.0 109.26 168.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.68 -39.79 68.45 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.546 -1.347 . . . . 0.0 109.677 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.462 ' HA ' ' CD2' ' B' ' 146' ' ' TYR . 2.4 ptpt -68.18 -6.31 22.69 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.449 2.699 . . . . 0.0 116.527 175.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -138.42 18.4 2.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.495 1.518 . . . . 0.0 112.143 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 23.4 ttm -60.09 123.76 18.13 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 120.023 1.283 . . . . 0.0 108.143 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.8 t -76.6 152.15 36.0 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.065 -175.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.195 -1.566 . . . . 0.0 112.763 -170.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -32.42 71.92 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 119.34 0.973 . . . . 0.0 112.38 173.5 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.41 -37.3 63.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.538 1.535 . . . . 0.0 111.231 174.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -64.01 -49.75 71.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.652 1.181 . . . . 0.0 113.203 175.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.0 pt -68.66 -3.88 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 176.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -103.78 -10.13 18.51 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.073 1.749 . . . . 0.0 114.053 169.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.77 160.76 32.11 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.702 -1.249 . . . . 0.0 110.464 171.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . 0.424 HD22 ' HD2' ' B' ' 98' ' ' LYS . 53.8 t-20 -69.44 130.47 90.75 Favored Pre-proline 0 N--CA 1.481 1.122 0 O-C-N 121.376 -0.827 . . . . 0.0 111.942 -178.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.13 -19.95 35.79 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.57 2.847 . . . . 0.0 115.614 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.424 ' HD2' HD22 ' B' ' 96' ' ' ASN . 33.8 mttt -55.81 -66.19 0.47 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.487 1.915 . . . . 0.0 110.386 168.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.37 -6.57 59.4 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.6 ttm -58.37 -38.02 76.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.97 -1.081 . . . . 0.0 111.313 168.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 63.3 m -60.48 -56.75 32.21 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 124.346 1.058 . . . . 0.0 112.598 -177.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -52.85 -44.61 46.95 Favored 'Trans proline' 0 C--N 1.357 1.001 0 C-N-CA 124.187 3.258 . . . . 0.0 115.408 171.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.21 -37.21 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 120.442 1.474 . . . . 0.0 112.896 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.79 -24.93 67.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.629 0.771 . . . . 0.0 110.975 175.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.505 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.4 t90 -83.14 -51.16 7.75 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.496 168.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.505 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.3 t90 -64.98 -33.55 76.31 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.673 1.579 . . . . 0.0 111.278 -168.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -57.17 -44.24 83.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.734 1.214 . . . . 0.0 112.352 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -33.33 75.62 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.294 1.438 . . . . 0.0 111.909 -173.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -98.68 -10.44 23.22 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 46.83 -72.01 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 130.141 3.377 . . . . 0.0 116.22 -168.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.79 137.25 56.49 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.783 0.801 . . . . 0.0 111.729 -167.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 10.6 p -66.87 -2.32 5.03 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -178.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.3 p -134.93 148.04 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 126.084 1.754 . . . . 0.0 110.96 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -79.84 159.97 26.27 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.41 1.084 . . . . 0.0 113.123 -177.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 152.8 41.35 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.151 1.381 . . . . 0.0 111.578 -168.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.32 -95.88 0.38 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.141 0.877 . . . . 0.0 111.549 -177.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.58 -163.28 23.33 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.519 1.057 . . . . 0.0 113.151 169.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -127.24 11.47 6.96 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.396 1.478 . . . . 0.0 114.214 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 3.9 m -78.25 61.39 2.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.338 1.455 . . . . 0.0 112.549 -172.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 7.0 t -59.02 -25.45 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.607 1.163 . . . . 0.0 111.695 175.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.86 138.34 19.02 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.658 1.183 . . . . 0.0 111.87 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 93.4 mt -67.05 126.23 28.52 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.523 -0.736 . . . . 0.0 110.871 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -95.15 166.71 11.78 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.025 1.33 . . . . 0.0 109.635 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.1 -30.16 71.37 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.72 -1.237 . . . . 0.0 112.432 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 89.3 m -64.98 -41.72 95.19 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.421 -0.799 . . . . 0.0 111.863 169.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -63.52 -47.68 80.67 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.107 1.321 . . . . 0.0 110.174 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.8 mt -58.13 -30.5 66.38 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.251 1.02 . . . . 0.0 112.515 175.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 91.2 m -80.29 -37.19 33.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.587 1.155 . . . . 0.0 112.104 174.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -74.15 -31.88 62.9 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.519 -1.363 . . . . 0.0 113.602 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.59 -51.84 75.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 120.068 1.304 . . . . 0.0 112.208 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.64 -33.19 36.48 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 CA-C-N 121.922 1.722 . . . . 0.0 113.5 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -62.99 -41.43 99.57 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.625 1.557 . . . . 0.0 113.008 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.44 -28.35 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.832 -0.542 . . . . 0.0 112.427 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 54.6 mt -67.23 -47.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.302 0.501 . . . . 0.0 110.318 172.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -57.99 -44.31 87.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.857 0.863 . . . . 0.0 111.624 172.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.73 -23.45 63.2 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.942 -1.099 . . . . 0.0 113.173 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.34 -51.12 8.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.626 1.103 . . . . 0.0 112.434 175.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -26.65 68.51 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 120.614 1.552 . . . . 0.0 113.508 173.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -73.02 -29.79 63.27 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.467 1.507 . . . . 0.0 114.663 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -131.63 64.87 74.45 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.51 -15.35 40.73 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.851 3.034 . . . . 0.0 116.483 -168.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -84.33 -12.84 53.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.561 1.144 . . . . 0.0 114.051 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -77.48 163.54 26.24 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.726 1.21 . . . . 0.0 112.529 -170.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -79.18 143.89 34.97 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.837 -0.54 . . . . 0.0 109.813 169.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.78 -39.51 85.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' B' ' 85' ' ' LYS . 3.0 m-30 -82.65 -26.7 31.92 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.9 t -61.58 -19.18 61.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.903 -1.123 . . . . 0.0 112.187 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.68 -4.19 1.9 Allowed 'General case' 0 CA--C 1.538 0.518 0 O-C-N 119.554 -1.966 . . . . 0.0 113.957 171.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -33.68 71.58 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.554 1.07 . . . . 0.0 111.965 166.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.01 -32.42 73.78 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -167.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -71.06 -28.2 64.19 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.744 2.018 . . . . 0.0 115.154 172.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -91.71 131.8 36.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -167.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 82.0 p -129.44 6.72 5.28 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 -176.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -67.7 132.85 48.25 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -169.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 13.9 t70 59.37 -31.85 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 129.635 3.174 . . . . 0.0 117.708 172.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.1 pp -64.88 148.93 97.09 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 126.069 1.748 . . . . 0.0 112.104 173.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.17 155.25 52.08 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.304 2.669 . . . . 0.0 113.013 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.975 1.71 . . . . 0.0 111.834 177.56 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 120.545 0.212 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -160.73 116.5 2.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 123.037 1.399 . . . . 0.0 108.379 168.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.501 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER -166.67 -176.93 3.7 Favored 'General case' 0 N--CA 1.422 -1.852 0 C-N-CA 130.048 3.339 . . . . 0.0 106.323 -165.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -128.94 57.58 1.62 Allowed 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 123.402 0.681 . . . . 0.0 109.947 169.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.501 ' H ' ' HG2' ' A' ' 3' ' ' GLU . . . -53.35 -40.64 65.08 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.166 1.348 . . . . 0.0 109.414 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.46 ' HA ' ' CD2' ' A' ' 67' ' ' TYR . 3.0 mppt? -45.39 -29.03 0.97 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 130.592 3.557 . . . . 0.0 114.893 169.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -134.77 21.99 3.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.963 1.705 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.4 ttm -60.05 120.02 8.91 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 177.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.3 t -74.97 152.1 38.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -173.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.35 -28.4 69.26 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.624 -1.297 . . . . 0.0 113.165 -170.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.41 90.94 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.886 0.766 . . . . 0.0 111.595 169.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -70.47 -37.14 74.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.257 1.023 . . . . 0.0 111.949 175.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -59.38 -52.29 66.27 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.349 -0.845 . . . . 0.0 112.812 174.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.2 pt -69.87 0.93 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 112.627 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -112.61 -14.76 13.14 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.072 1.749 . . . . 0.0 114.02 173.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.03 162.72 21.51 Favored 'General case' 0 CA--C 1.552 1.049 0 O-C-N 120.88 -1.137 . . . . 0.0 110.127 169.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.416 HD22 ' HD3' ' A' ' 19' ' ' LYS . 50.4 t-20 -68.22 129.93 92.68 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 120.823 -1.173 . . . . 0.0 112.409 -175.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -58.81 -12.31 14.45 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.269 3.312 . . . . 0.0 116.15 176.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.416 ' HD3' HD22 ' A' ' 17' ' ' ASN . 7.6 mttt -65.37 -63.06 1.19 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.334 1.854 . . . . 0.0 108.669 166.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.62 0.92 44.75 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 72.8 mtp -59.54 -38.5 81.22 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.818 -1.176 . . . . 0.0 112.116 169.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 21.8 m -66.64 -51.53 39.97 Favored Pre-proline 0 N--CA 1.48 1.045 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -49.5 -46.75 25.32 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.66 2.907 . . . . 0.0 116.132 169.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.09 -39.65 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 120.954 -1.091 . . . . 0.0 112.765 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.12 -27.33 68.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.558 0.743 . . . . 0.0 111.803 173.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 81.1 t90 -83.43 -52.21 6.72 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.727 171.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.434 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.4 t90 -66.05 -34.63 78.53 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 120.213 1.37 . . . . 0.0 111.517 -168.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -56.58 -42.83 79.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.988 1.315 . . . . 0.0 111.731 171.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.6 -18.99 65.73 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.679 1.592 . . . . 0.0 113.788 175.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -108.18 -7.66 15.96 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 57.87 13.74 2.24 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 125.752 1.621 . . . . 0.0 115.108 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 49.26 30.91 3.36 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.207 1.403 . . . . 0.0 112.269 -166.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.8 t -69.53 -9.61 54.62 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -171.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.257 0.4 OUTLIER 65.05 152.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 127.404 2.282 . . . . 0.0 113.487 -170.416 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -85.36 137.14 33.14 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.912 0.885 . . . . 0.0 111.93 -177.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -150.8 146.48 26.4 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.205 1.402 . . . . 0.0 111.25 -169.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.57 -77.6 0.26 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.183 0.896 . . . . 0.0 111.343 -170.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.68 177.37 54.39 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.624 1.106 . . . . 0.0 112.35 168.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -143.14 16.89 1.91 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.505 ' C ' ' H ' ' A' ' 42' ' ' THR . 7.3 p -65.74 -51.9 55.46 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -173.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t 61.58 -20.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 125.658 1.583 . . . . 0.0 114.602 -169.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.505 ' H ' ' C ' ' A' ' 40' ' ' THR . 43.0 p -44.48 149.46 0.39 Allowed 'General case' 0 C--O 1.238 0.487 0 C-N-CA 128.314 2.646 . . . . 0.0 114.738 -175.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mt -70.86 73.47 0.58 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 122.733 1.254 . . . . 0.0 109.434 165.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -66.0 167.9 9.08 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.506 2.723 . . . . 0.0 112.117 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -68.13 -22.67 64.87 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.667 -1.271 . . . . 0.0 114.304 -172.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.9 m -65.55 -49.97 66.93 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.218 0.917 . . . . 0.0 110.141 169.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -55.99 -51.83 66.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.804 0.729 . . . . 0.0 110.779 173.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -61.11 -30.63 70.47 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.41 0.684 . . . . 0.0 112.234 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.1 m -73.78 -38.29 64.71 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.375 0.67 . . . . 0.0 111.39 173.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -82.07 -24.22 35.37 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.667 -175.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.2 mm -52.49 -48.66 89.28 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 120.504 1.502 . . . . 0.0 111.79 177.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.4 -37.59 22.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 CA-C-N 121.484 1.566 . . . . 0.0 113.342 172.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.05 -37.02 84.78 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.671 -1.268 . . . . 0.0 113.292 -175.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.14 -22.19 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.7 mt -81.09 -50.95 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.562 0.745 . . . . 0.0 110.116 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -59.54 -39.61 84.52 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.08 0.952 . . . . 0.0 112.008 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.75 -30.33 70.52 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 122.952 0.501 . . . . 0.0 111.373 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.68 -46.89 28.74 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 174.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -29.97 68.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 121.094 1.77 . . . . 0.0 114.145 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.88 -34.52 60.0 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -132.04 78.08 70.1 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.506 1.123 . . . . 0.0 111.932 171.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -54.58 -12.57 4.49 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.844 3.696 . . . . 0.0 117.462 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.32 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.229 1.412 . . . . 0.0 112.817 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -66.07 159.5 25.91 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 113.1 -171.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -84.13 138.84 32.81 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.636 -0.665 . . . . 0.0 109.389 169.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.22 -34.33 66.21 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 172.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.46 ' CD2' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -85.36 -29.66 24.28 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 115.558 1.688 . . . . 0.0 115.558 -173.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.7 t -64.28 -12.48 41.94 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.11 -0.994 . . . . 0.0 112.078 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -66.34 -3.69 6.46 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 119.662 -1.899 . . . . 0.0 113.737 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 -30.55 32.94 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.431 1.492 . . . . 0.0 111.955 167.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -66.68 -28.52 68.52 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.11 1.364 . . . . 0.0 112.074 -173.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.05 -30.01 55.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 114.79 173.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -108.84 97.86 7.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -166.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -75.48 104.74 6.16 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 167.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -80.16 178.19 8.42 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.7 0.8 . . . . 0.0 112.211 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.82 47.31 0.41 Allowed 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.515 1.926 . . . . 0.0 114.24 -173.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -150.02 159.1 36.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 127.275 2.23 . . . . 0.0 112.263 -178.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -69.83 159.63 52.67 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.058 2.505 . . . . 0.0 112.424 169.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.326 1.05 . . . . 0.0 112.071 173.186 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.959 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 50.3 t30 58.91 49.7 9.39 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.691 1.597 . . . . 0.0 114.294 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.56 -19.59 62.34 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.729 0.812 . . . . 0.0 112.968 168.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 11.6 t 103.98 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 129.552 3.141 . . . . 0.0 114.343 169.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -33.7 71.84 Favored 'General case' 0 CA--C 1.554 1.099 0 O-C-N 120.522 -1.361 . . . . 0.0 110.711 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -41.25 74.95 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.104 2.162 . . . . 0.0 113.454 173.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.77 8.16 39.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.066 1.347 . . . . 0.0 113.297 -174.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.0 ttm -62.59 123.08 17.43 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 109.904 172.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -77.78 155.34 31.2 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.041 -1.037 . . . . 0.0 110.494 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.84 -32.84 74.14 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.274 -1.516 . . . . 0.0 112.984 -174.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.85 -31.65 72.9 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.871 0.76 . . . . 0.0 112.871 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -80.18 -36.63 34.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.306 1.443 . . . . 0.0 111.357 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -61.45 -48.55 80.64 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.784 0.834 . . . . 0.0 112.611 175.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.45 -1.43 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 123.73 0.812 . . . . 0.0 113.163 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -110.56 -9.29 14.56 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.38 1.872 . . . . 0.0 114.076 172.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 155.72 40.08 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 119.875 1.216 . . . . 0.0 110.702 174.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -67.75 130.84 92.84 Favored Pre-proline 0 N--CA 1.479 0.982 0 O-C-N 121.292 -0.88 . . . . 0.0 110.624 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -46.58 -35.06 16.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.193 3.262 . . . . 0.0 114.117 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 59.3 mttt -60.39 -14.8 20.85 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -132.92 19.01 4.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.891 1.678 . . . . 0.0 112.609 166.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.1 ttm -70.0 -52.01 27.68 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.802 1.241 . . . . 0.0 110.88 169.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 2.7 m -45.76 -56.62 9.63 Favored Pre-proline 0 N--CA 1.489 1.519 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.88 -43.29 58.49 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.052 3.168 . . . . 0.0 115.389 175.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.39 -38.3 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.184 1.356 . . . . 0.0 112.724 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.04 -26.99 68.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.99 0.916 . . . . 0.0 111.042 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.507 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.7 t90 -84.01 -52.87 5.97 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.294 168.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.507 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.8 t90 -64.33 -31.18 72.28 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 120.048 1.295 . . . . 0.0 112.683 -166.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -61.61 -49.31 77.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.592 1.157 . . . . 0.0 111.406 172.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.73 -28.63 65.96 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.492 1.517 . . . . 0.0 111.802 -177.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -153.34 94.58 1.83 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.91 1.684 . . . . 0.0 109.635 -171.011 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . 0.407 ' C ' ' H ' ' B' ' 112' ' ' THR . 4.0 mp0 -71.41 166.73 21.07 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 -171.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.38 18.68 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 O-C-N 120.689 -1.257 . . . . 0.0 114.347 168.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' THR . . . . . 0.407 ' H ' ' C ' ' B' ' 110' ' ' GLU . 14.5 t -58.66 149.25 26.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.987 1.315 . . . . 0.0 112.207 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.34 120.57 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 123.921 0.888 . . . . 0.0 109.232 -176.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.94 160.02 21.16 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 116.029 1.863 . . . . 0.0 116.029 -166.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -152.57 149.37 28.42 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.658 1.583 . . . . 0.0 112.231 -170.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.09 3.63 31.27 Favored Glycine 0 CA--C 1.539 1.568 0 N-CA-C 117.167 1.627 . . . . 0.0 117.167 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 169.82 -160.26 33.23 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.893 1.346 . . . . 0.0 113.307 -176.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -130.4 17.25 5.42 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.828 1.651 . . . . 0.0 114.065 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 12.0 p -72.81 37.18 0.08 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 127.066 2.146 . . . . 0.0 115.726 -170.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.7 m -78.93 -12.89 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 120.514 -1.366 . . . . 0.0 113.947 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.98 168.41 11.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.403 1.481 . . . . 0.0 110.901 167.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 40.0 mt -63.18 115.97 4.99 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.986 -1.071 . . . . 0.0 110.625 168.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -92.54 173.27 7.87 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.065 1.346 . . . . 0.0 111.193 175.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.04 -36.61 73.0 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.431 -0.793 . . . . 0.0 112.385 177.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 42.4 m -65.28 -43.58 90.74 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.573 -0.704 . . . . 0.0 111.519 172.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -66.05 -51.82 54.71 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.997 -1.064 . . . . 0.0 111.36 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.72 -23.13 65.94 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -82.96 -33.26 26.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 119.284 -0.388 . . . . 0.0 112.021 172.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.64 -27.38 29.16 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.01 -42.43 85.29 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 120.599 1.545 . . . . 0.0 113.495 176.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.39 -35.07 5.23 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 CA-C-N 122.438 1.906 . . . . 0.0 113.476 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -66.69 -32.12 73.23 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.261 -1.525 . . . . 0.0 113.42 -176.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.26 -29.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.721 -0.612 . . . . 0.0 112.122 172.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -71.26 -49.42 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.47 0.708 . . . . 0.0 110.151 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -57.56 -41.69 81.52 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.426 0.69 . . . . 0.0 111.995 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -67.94 -34.67 77.04 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 118.986 0.812 . . . . 0.0 112.295 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.14 -44.62 68.48 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.263 -0.898 . . . . 0.0 112.413 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -29.29 65.35 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.446 1.475 . . . . 0.0 114.865 179.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -76.38 -27.44 56.39 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 170.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -132.97 73.05 76.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.019 1.328 . . . . 0.0 111.636 172.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -59.22 -11.57 13.53 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.037 3.158 . . . . 0.0 116.279 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -81.37 -23.19 37.85 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.78 1.632 . . . . 0.0 113.916 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -65.33 157.54 28.87 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.831 1.252 . . . . 0.0 111.279 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -96.07 133.61 40.12 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 118.322 -0.847 . . . . 0.0 109.289 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.8 tp -50.62 -38.52 46.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -168.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.273 4.8 m-85 -82.33 -1.02 48.36 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -177.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 62.4 p -64.99 -32.15 73.73 Favored 'General case' 0 N--CA 1.483 1.214 0 O-C-N 120.582 -1.324 . . . . 0.0 110.925 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -69.73 -1.87 10.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.415 1.486 . . . . 0.0 113.649 -176.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -77.7 -38.7 46.82 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.84 1.656 . . . . 0.0 112.244 167.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -27.62 64.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -167.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -70.28 -29.2 65.9 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.018 1.727 . . . . 0.0 114.581 170.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.89 -45.96 4.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -167.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 47.9 m 46.61 40.74 8.9 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -84.17 5.41 26.44 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -172.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -80.52 24.26 0.47 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.421 1.888 . . . . 0.0 114.695 -172.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -160.7 149.7 13.65 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.271 2.229 . . . . 0.0 110.105 171.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.73 160.84 48.1 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.536 2.824 . . . . 0.0 112.478 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.0 t30 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 125.751 1.62 . . . . 0.0 111.239 178.913 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.321 9.2 t-20 69.87 34.05 2.69 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 172.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -74.67 158.38 33.72 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.951 2.1 . . . . 0.0 106.226 163.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.8 t -99.37 92.69 5.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.699 1.2 . . . . 0.0 113.073 -165.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.13 -31.28 67.03 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.524 -1.36 . . . . 0.0 111.359 176.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.433 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.2 ptpt -74.52 -10.2 59.32 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 177.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -121.03 14.78 11.52 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.049 1.339 . . . . 0.0 111.821 168.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.42 118.95 7.62 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.855 -1.153 . . . . 0.0 108.016 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -76.53 154.87 34.18 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.176 -0.953 . . . . 0.0 109.672 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.15 -32.64 74.07 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.455 -1.403 . . . . 0.0 113.197 -172.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -62.82 -33.77 75.91 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 170.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -77.12 -37.16 54.67 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.071 1.349 . . . . 0.0 111.361 175.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -60.0 -50.15 74.88 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 121.469 -0.769 . . . . 0.0 112.353 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.8 pt -69.41 -2.84 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 124.561 1.144 . . . . 0.0 112.981 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -106.02 -12.11 15.91 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.249 1.42 . . . . 0.0 113.738 172.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.59 165.87 23.85 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.119 0.968 . . . . 0.0 110.474 170.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -72.34 131.98 84.43 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.786 -1.196 . . . . 0.0 111.74 -176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.1 -30.67 41.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.229 3.286 . . . . 0.0 116.077 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.2 mttt -51.5 -59.28 4.43 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.456 1.902 . . . . 0.0 108.893 169.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 178.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 78.0 mtp -61.85 -35.38 78.1 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.065 1.302 . . . . 0.0 111.343 169.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 28.2 m -64.38 -54.15 40.36 Favored Pre-proline 0 N--CA 1.48 1.048 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -175.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -52.46 -39.04 75.11 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 123.493 2.796 . . . . 0.0 116.094 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.8 p -78.03 -34.56 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.61 1.095 . . . . 0.0 113.491 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -24.67 67.93 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.334 1.053 . . . . 0.0 110.62 172.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.516 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 68.7 t90 -85.74 -56.46 3.48 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 117.939 -1.029 . . . . 0.0 112.612 168.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.6 t90 -64.88 -28.99 69.92 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 120.655 1.571 . . . . 0.0 112.759 -166.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -61.42 -52.12 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.338 1.055 . . . . 0.0 111.357 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -26.58 65.87 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.839 1.656 . . . . 0.0 111.955 -175.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -111.28 6.33 20.47 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 62.13 144.74 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 128.285 2.634 . . . . 0.0 117.019 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.3 -3.74 38.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.1 p -87.06 -98.95 0.08 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.718 1.207 . . . . 0.0 112.206 -170.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.417 ' O ' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -158.54 147.24 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 125.063 1.345 . . . . 0.0 109.357 -171.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -82.04 31.96 0.38 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 116.107 1.892 . . . . 0.0 116.107 -168.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' A' ' 34' ' ' VAL . 17.5 mmtt 59.33 17.91 6.25 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.234 1.814 . . . . 0.0 115.022 169.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.19 -0.33 88.79 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 125.478 1.513 . . . . 0.0 114.991 -173.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.38 171.57 55.14 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 119.091 1.446 . . . . 0.0 112.817 169.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -119.67 -23.9 6.39 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.28 5.8 t -82.84 54.48 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 123.043 1.402 . . . . 0.0 112.896 -171.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.06 -12.87 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 124.702 1.201 . . . . 0.0 112.481 170.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.05 144.8 27.65 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.276 1.831 . . . . 0.0 112.532 174.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 29.4 mt -84.32 151.59 24.65 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.441 1.115 . . . . 0.0 112.749 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -143.51 168.74 19.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.547 2.339 . . . . 0.0 109.214 -168.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.96 -24.02 66.72 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -169.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 m -63.63 -48.15 78.47 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.35 0.977 . . . . 0.0 110.569 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -64.35 -41.68 96.63 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.412 -0.805 . . . . 0.0 110.973 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.2 mt -65.11 -24.01 67.31 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.778 -0.576 . . . . 0.0 112.541 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.9 m -80.01 -33.4 39.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.922 1.289 . . . . 0.0 111.319 172.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.4 mm100 -82.64 -30.33 29.44 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.729 1.149 . . . . 0.0 113.249 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.7 -41.84 85.98 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 120.277 1.399 . . . . 0.0 113.423 175.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.1 -36.58 7.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 122.392 1.89 . . . . 0.0 113.429 169.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -66.17 -35.15 79.7 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.778 1.626 . . . . 0.0 113.817 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.03 -17.45 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 174.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -88.68 -52.09 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.255 1.022 . . . . 0.0 110.904 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.91 -42.17 71.88 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.082 0.953 . . . . 0.0 110.947 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.15 -30.7 70.76 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.049 -0.407 . . . . 0.0 111.403 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.9 m -74.68 -45.12 46.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.101 -0.952 . . . . 0.0 113.199 174.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.8 69.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 120.883 1.674 . . . . 0.0 114.166 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -82.2 -26.55 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -130.75 75.02 79.42 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 125.606 1.563 . . . . 0.0 110.912 170.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -60.75 -11.28 16.95 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.799 3.666 . . . . 0.0 115.871 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -80.28 -25.37 39.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.832 1.653 . . . . 0.0 112.782 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -69.96 160.51 31.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.43 1.492 . . . . 0.0 111.955 -172.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.62 146.92 26.64 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.561 -0.712 . . . . 0.0 110.058 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 57.1 tp -61.97 -31.63 72.0 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.263 -0.898 . . . . 0.0 113.219 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.433 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 2.4 m-85 -89.62 -24.87 21.56 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 -171.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -63.02 -15.43 56.43 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.863 -1.148 . . . . 0.0 112.071 171.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -66.26 -5.89 11.95 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.513 -1.992 . . . . 0.0 113.743 169.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -34.51 60.57 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.44 1.496 . . . . 0.0 111.606 167.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -62.96 -25.13 68.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.176 1.79 . . . . 0.0 112.774 -170.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -85.08 -30.89 23.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.423 1.889 . . . . 0.0 115.955 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.19 -52.39 5.09 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 -166.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.2 m 44.9 30.42 0.56 Allowed 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -85.22 -9.5 57.7 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.87 1.268 . . . . 0.0 114.089 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -94.58 39.4 1.09 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.812 3.245 . . . . 0.0 116.054 -167.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.22 152.82 19.03 Favored Pre-proline 0 CA--C 1.547 0.838 0 O-C-N 121.481 -0.762 . . . . 0.0 113.014 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -66.01 160.63 43.48 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.93 2.42 . . . . 0.0 111.876 168.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.478 1.511 . . . . 0.0 113.518 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.944 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 58.9 t-20 68.09 -69.1 0.15 Allowed 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 128.917 2.887 . . . . 0.0 111.881 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.258 50.1 mm-40 58.22 -26.77 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 -175.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 101.42 93.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 131.14 3.776 . . . . 0.0 115.008 169.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.14 -34.17 69.97 Favored 'General case' 0 CA--C 1.555 1.136 0 O-C-N 120.383 -1.448 . . . . 0.0 110.641 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.418 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 15.5 mtmt -58.4 -34.75 71.09 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.3 1.84 . . . . 0.0 114.538 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -105.44 8.73 33.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.914 1.285 . . . . 0.0 112.976 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.9 ttm -62.38 123.79 19.2 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.635 1.107 . . . . 0.0 109.662 171.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -76.32 154.7 34.83 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 121.015 -1.053 . . . . 0.0 110.307 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.38 -31.95 73.24 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.162 -1.586 . . . . 0.0 113.187 -173.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -65.29 -32.49 74.17 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.155 0.889 . . . . 0.0 112.933 172.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -77.85 -37.35 48.58 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.303 1.441 . . . . 0.0 111.298 176.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -62.83 -47.69 82.33 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.547 -0.72 . . . . 0.0 112.75 176.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -69.76 -3.53 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -104.49 -10.61 17.54 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.043 1.737 . . . . 0.0 114.251 170.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.69 160.42 32.66 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 119.895 1.225 . . . . 0.0 110.895 173.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -65.72 129.96 94.43 Favored Pre-proline 0 N--CA 1.48 1.062 0 O-C-N 121.118 -0.989 . . . . 0.0 111.571 -178.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.43 -17.38 47.39 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.278 2.652 . . . . 0.0 114.783 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 mptt -54.69 -69.39 0.13 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.501 1.52 . . . . 0.0 109.889 168.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.87 -11.53 60.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -175.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -54.58 -35.5 63.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 120.618 -1.302 . . . . 0.0 112.532 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 32.4 m -61.87 -57.8 21.93 Favored Pre-proline 0 N--CA 1.483 1.208 0 CA-C-O 117.719 -1.134 . . . . 0.0 113.542 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -53.95 -37.1 85.68 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.97 3.114 . . . . 0.0 114.244 169.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 55.9 t -62.71 -50.14 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.562 -0.711 . . . . 0.0 111.534 174.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.11 -40.28 95.87 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.185 0.994 . . . . 0.0 109.897 -176.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.489 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 75.1 t90 -68.36 -49.65 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 116.991 -1.481 . . . . 0.0 112.592 172.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.85 -26.41 65.13 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 121.416 1.916 . . . . 0.0 111.268 -170.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -63.29 -48.83 76.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.385 1.074 . . . . 0.0 111.045 169.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.16 -31.67 72.97 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.865 1.266 . . . . 0.0 112.172 -179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.35 63.91 0.73 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 111.971 171.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -54.1 -42.04 68.93 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.047 1.339 . . . . 0.0 114.613 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.14 125.56 24.91 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.891 0.853 . . . . 0.0 111.915 -171.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 38.0 p -69.42 -4.08 17.02 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -175.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -133.59 147.16 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.313 1.045 . . . . 0.0 111.898 170.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -111.99 147.9 34.95 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -169.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -131.48 160.56 34.82 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.903 1.681 . . . . 0.0 112.419 -170.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.08 28.67 67.98 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.943 0.782 . . . . 0.0 113.576 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 107.42 -155.35 16.34 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.721 1.629 . . . . 0.0 111.822 -169.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -119.0 26.91 9.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 11.5 p -72.35 42.97 0.1 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.953 2.101 . . . . 0.0 115.015 -173.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 m -62.16 -13.45 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.629 1.172 . . . . 0.0 112.447 168.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.22 136.69 11.75 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.912 1.685 . . . . 0.0 110.734 169.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 8.6 mp -75.01 113.92 12.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.472 0.653 . . . . 0.0 110.414 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -76.86 168.18 20.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.777 1.631 . . . . 0.0 109.35 171.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -63.02 -26.84 69.04 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.561 -1.337 . . . . 0.0 112.376 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -45.4 91.26 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 121.419 -0.801 . . . . 0.0 111.493 168.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -64.38 -46.37 83.63 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.662 1.119 . . . . 0.0 110.265 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -59.31 -30.43 68.33 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.767 0.827 . . . . 0.0 112.423 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 86.8 m -78.75 -36.89 42.45 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.426 1.09 . . . . 0.0 111.625 174.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -78.66 -32.65 47.28 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.947 -1.095 . . . . 0.0 113.741 -176.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.41 -45.24 95.26 Favored Pre-proline 0 N--CA 1.481 1.087 0 CA-C-N 120.364 1.438 . . . . 0.0 113.09 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.69 -34.99 8.31 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 122.228 1.831 . . . . 0.0 113.277 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -66.19 -32.78 74.42 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.329 -1.482 . . . . 0.0 113.983 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 23.0 m -71.59 -27.19 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 121.798 -0.564 . . . . 0.0 111.878 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -72.3 -47.29 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.463 0.705 . . . . 0.0 110.131 170.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -57.88 -41.06 81.73 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.697 0.799 . . . . 0.0 112.075 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.73 -32.35 74.0 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.279 0.945 . . . . 0.0 112.263 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.37 -47.4 56.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.876 -1.14 . . . . 0.0 112.428 176.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.85 -29.02 66.17 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 120.555 1.525 . . . . 0.0 114.804 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -74.41 -28.53 61.11 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 170.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -134.21 73.91 68.63 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.073 1.349 . . . . 0.0 111.71 173.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -59.93 -11.11 14.02 Favored 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 124.018 3.145 . . . . 0.0 116.033 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -81.0 -22.63 39.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.929 1.692 . . . . 0.0 114.175 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -63.89 155.47 30.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.237 1.415 . . . . 0.0 111.085 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -91.33 133.73 35.19 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.8 tp -51.07 -39.01 55.05 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -168.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.418 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.7 m-85 -81.43 -5.54 58.01 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -176.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 77.0 p -59.22 -27.44 65.75 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.378 -1.451 . . . . 0.0 111.163 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -72.48 -2.48 19.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.209 1.404 . . . . 0.0 113.666 177.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -80.31 -32.06 38.06 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.747 1.158 . . . . 0.0 111.748 167.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -64.34 -26.62 68.56 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.201 1.0 . . . . 0.0 112.738 -169.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -77.01 -27.76 54.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.385 2.274 . . . . 0.0 116.149 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -103.22 113.47 26.98 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -166.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 31.1 m -121.03 37.59 4.28 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.364 1.466 . . . . 0.0 113.465 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -74.84 147.93 40.69 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -171.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 26.4 t70 60.04 -54.76 0.07 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 130.253 3.421 . . . . 0.0 118.137 170.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.06 150.59 74.94 Favored Pre-proline 0 CA--C 1.553 1.069 0 C-N-CA 124.432 1.093 . . . . 0.0 113.167 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -73.59 155.18 49.97 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.517 2.811 . . . . 0.0 112.487 175.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.244 0 C-N-CA 126.006 1.723 . . . . 0.0 110.986 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.892 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.4 t30 56.35 47.88 18.17 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.069 1.748 . . . . 0.0 115.034 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -62.71 -21.17 65.57 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.995 167.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.7 t 98.59 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 128.72 2.808 . . . . 0.0 117.361 164.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.9 -34.89 73.78 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 119.88 -1.763 . . . . 0.0 112.091 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -72.12 -4.42 28.93 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 175.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.65 5.15 11.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.501 1.52 . . . . 0.0 112.445 169.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.3 ttm -62.56 125.67 24.73 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.641 -1.287 . . . . 0.0 109.54 175.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.71 154.79 29.8 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.402 -0.811 . . . . 0.0 110.496 179.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.03 -34.11 75.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.413 -1.429 . . . . 0.0 113.083 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.49 -31.86 73.15 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.715 0.806 . . . . 0.0 112.871 172.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -78.44 -38.13 42.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.958 1.303 . . . . 0.0 111.697 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -58.81 -50.03 75.47 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.533 0.733 . . . . 0.0 112.452 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.0 pt -67.86 -7.18 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.43 1.092 . . . . 0.0 112.98 177.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.51 -7.95 17.28 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.85 1.66 . . . . 0.0 113.607 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.23 159.29 32.7 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 110.702 175.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -64.93 128.87 94.16 Favored Pre-proline 0 N--CA 1.483 1.184 0 O-C-N 121.222 -0.924 . . . . 0.0 112.088 -173.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -56.91 -16.58 20.82 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.838 3.026 . . . . 0.0 115.247 178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -61.71 -69.71 0.23 Allowed 'General case' 0 C--N 1.348 0.524 0 C-N-CA 125.819 1.648 . . . . 0.0 110.15 167.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.28 -3.12 48.09 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.5 ttt -58.91 -36.65 75.07 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 169.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -65.43 -51.5 51.55 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.437 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 5.8 Cg_endo -51.55 -47.71 24.87 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.048 2.499 . . . . 0.0 114.904 169.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 p -67.36 -37.53 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.788 -1.195 . . . . 0.0 113.162 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.46 -17.34 63.74 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.158 0.983 . . . . 0.0 112.854 175.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.467 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.7 t90 -97.97 -45.24 6.35 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.922 1.237 . . . . 0.0 111.814 168.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 31.5 t-105 -59.33 -34.29 72.16 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.108 0.963 . . . . 0.0 111.456 -172.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -74.13 -51.6 15.13 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.453 169.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -71.01 -39.35 72.44 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -168.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.482 ' CG ' HD21 ' A' ' 75' ' ' ASN . 0.9 OUTLIER -85.93 -40.67 15.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.669 0.668 . . . . 0.0 111.765 172.21 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 73.71 116.79 0.05 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.827 2.451 . . . . 0.0 114.094 -176.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.88 102.14 7.14 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 169.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.1 t -145.85 39.85 1.15 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.209 1.404 . . . . 0.0 110.35 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.0 t 61.78 153.28 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 127.878 2.471 . . . . 0.0 111.697 -167.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . 0.295 2.1 t80 -101.57 18.03 21.3 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.259 2.318 . . . . 0.0 117.259 -168.397 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.39 37.74 9.32 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.931 1.692 . . . . 0.0 114.749 169.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.48 3.45 77.87 Favored Glycine 0 CA--C 1.546 1.992 0 C-N-CA 125.767 1.651 . . . . 0.0 116.506 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.57 -173.41 49.7 Favored Glycine 0 CA--C 1.539 1.582 0 CA-C-N 119.492 1.646 . . . . 0.0 114.272 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -129.96 -14.77 3.92 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 29.7 p -77.62 36.52 0.21 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -173.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.5 m -60.94 -16.98 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 112.17 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.58 155.38 0.16 Allowed 'General case' 0 C--O 1.236 0.359 0 C-N-CA 127.921 2.488 . . . . 0.0 113.289 169.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.4 tp -77.59 79.11 4.1 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 167.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -67.18 170.16 7.48 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.896 1.278 . . . . 0.0 112.503 -173.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -64.04 -30.86 71.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 120.411 -1.43 . . . . 0.0 112.926 -178.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.8 m -62.06 -47.43 84.73 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.56 -0.713 . . . . 0.0 110.645 168.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.9 -43.71 98.07 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.543 -0.723 . . . . 0.0 110.791 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.52 -27.42 69.14 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.806 -1.184 . . . . 0.0 112.185 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 90.8 m -76.06 -36.79 58.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.569 0.747 . . . . 0.0 111.45 170.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -84.56 -27.6 27.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -176.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.25 -42.17 85.2 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 120.235 1.38 . . . . 0.0 112.918 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.47 -37.46 5.56 Favored 'Trans proline' 0 C--N 1.352 0.756 0 CA-C-N 122.145 1.802 . . . . 0.0 113.02 169.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -67.84 -33.09 74.09 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.226 -1.546 . . . . 0.0 113.76 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.6 m -68.21 -17.27 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.908 0.776 . . . . 0.0 113.083 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -87.43 -52.1 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.72 1.208 . . . . 0.0 110.186 172.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -56.67 -40.33 75.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.423 1.089 . . . . 0.0 111.838 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -71.96 -24.88 61.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.552 -0.717 . . . . 0.0 111.12 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.95 -43.69 21.63 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.318 -0.864 . . . . 0.0 112.193 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -27.78 69.53 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 120.444 1.475 . . . . 0.0 113.586 172.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -71.59 -37.7 70.96 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 169.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -125.22 63.53 42.64 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.001 1.32 . . . . 0.0 111.353 -176.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.17 -13.48 16.07 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.189 3.259 . . . . 0.0 115.905 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -86.1 -21.12 27.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.765 1.626 . . . . 0.0 113.581 -178.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -70.26 160.18 32.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.933 0.893 . . . . 0.0 112.008 -172.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.58 132.05 39.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -50.03 -36.61 29.53 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.5 m-85 -80.52 -9.33 59.77 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.795 -1.19 . . . . 0.0 114.06 -176.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -60.68 -26.83 67.39 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.646 -1.284 . . . . 0.0 111.348 168.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -71.88 -2.47 18.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.348 1.459 . . . . 0.0 114.274 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 -31.77 24.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.815 1.189 . . . . 0.0 111.678 168.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.78 -28.11 63.4 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.889 1.276 . . . . 0.0 111.87 -171.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -69.98 -30.19 67.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.75 1.22 . . . . 0.0 114.008 171.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.68 -44.15 6.54 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -167.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.0 m 62.06 -39.42 0.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 127.689 2.396 . . . . 0.0 115.479 -168.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.482 HD21 ' CG ' ' A' ' 30' ' ' HIS 0.283 2.3 t30 67.4 179.7 0.22 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 129.522 3.129 . . . . 0.0 116.305 172.476 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -70.83 -1.78 12.78 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 118.385 2.735 . . . . 0.0 118.385 -165.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.91 147.98 97.92 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 119.841 1.2 . . . . 0.0 112.788 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -63.76 161.17 33.47 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.775 2.317 . . . . 0.0 113.717 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.892 1.677 . . . . 0.0 113.951 -179.011 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.847 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 57.45 50.69 10.86 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.935 1.694 . . . . 0.0 114.26 176.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -65.85 -20.04 66.09 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.829 -1.081 . . . . 0.0 113.088 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 61.1 m 107.51 84.06 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 129.857 3.263 . . . . 0.0 115.761 167.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.29 69.16 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.243 -1.536 . . . . 0.0 111.751 175.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.464 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 8.3 ptpt -77.7 3.03 15.02 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 175.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -125.9 7.97 7.42 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.942 1.297 . . . . 0.0 112.194 169.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 34.5 ttm -62.71 125.04 22.6 Favored 'General case' 0 C--N 1.346 0.457 0 O-C-N 121.048 -1.032 . . . . 0.0 109.597 176.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.4 t -77.63 153.15 33.44 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.81 -0.556 . . . . 0.0 110.1 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.05 -30.62 71.68 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 120.475 -1.391 . . . . 0.0 112.978 -173.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -64.67 -31.67 73.0 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.857 0.753 . . . . 0.0 112.847 170.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -78.53 -38.39 40.65 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.854 1.261 . . . . 0.0 111.414 174.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -59.7 -48.15 82.83 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 121.541 -0.724 . . . . 0.0 112.728 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.57 -2.28 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.961 0.904 . . . . 0.0 113.116 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -109.31 -12.68 14.73 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.282 1.833 . . . . 0.0 114.112 173.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 157.78 35.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.944 1.247 . . . . 0.0 111.032 172.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -66.59 130.21 94.1 Favored Pre-proline 0 N--CA 1.483 1.178 0 O-C-N 121.462 -0.774 . . . . 0.0 111.614 -175.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.82 -18.3 33.75 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.562 2.841 . . . . 0.0 115.188 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 33.8 mttt -58.5 -68.69 0.23 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.07 1.748 . . . . 0.0 109.512 167.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.31 -2.49 49.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -177.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.9 ttm -61.92 -36.99 82.98 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 120.71 -1.243 . . . . 0.0 111.811 168.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 49.8 m -63.88 -52.26 58.38 Favored Pre-proline 0 N--CA 1.483 1.202 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.827 -177.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . 0.416 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 3.1 Cg_exo -47.8 -49.56 13.4 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 124.303 3.335 . . . . 0.0 114.932 169.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.91 -33.9 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 119.201 0.909 . . . . 0.0 113.205 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -25.13 67.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.807 0.843 . . . . 0.0 112.007 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 70.2 t90 -83.55 -55.85 4.06 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.078 165.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.4 t90 -62.62 -34.45 77.05 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 117.534 -1.666 . . . . 0.0 114.108 -162.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -64.74 -43.29 93.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.15 0.98 . . . . 0.0 111.601 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.49 -31.19 65.18 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.209 1.804 . . . . 0.0 111.739 -177.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -146.74 91.74 2.06 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.576 1.95 . . . . 0.0 108.946 -172.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.11 163.39 26.66 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -169.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 12.97 0.31 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 171.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 25.2 p -70.9 30.87 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 126.892 2.077 . . . . 0.0 115.873 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 64.3 t 65.9 120.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 130.054 3.342 . . . . 0.0 113.044 178.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -80.56 142.4 34.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.999 -168.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -130.87 -11.37 3.82 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -168.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.46 -8.0 83.86 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.135 0.874 . . . . 0.0 114.168 171.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 147.47 -133.89 4.92 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.992 1.758 . . . . 0.0 110.692 -173.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -124.55 6.27 8.26 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.008 1.723 . . . . 0.0 113.781 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 8.2 p -80.29 60.7 3.83 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.249 2.22 . . . . 0.0 112.526 -175.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.78 5.6 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.275 1.03 . . . . 0.0 113.742 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -49.36 149.73 2.09 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.171 2.588 . . . . 0.0 113.721 171.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.89 114.08 5.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 168.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -79.42 168.53 19.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.235 1.014 . . . . 0.0 109.69 172.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.69 -25.67 68.31 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.483 -1.386 . . . . 0.0 111.767 173.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 25.1 m -64.38 -44.01 92.7 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 118.501 -0.761 . . . . 0.0 111.122 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -61.14 -50.75 71.93 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.812 1.187 . . . . 0.0 110.107 174.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -57.48 -29.49 64.31 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.615 0.766 . . . . 0.0 112.476 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.9 m -81.21 -36.1 30.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.475 1.11 . . . . 0.0 112.161 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.48 -29.39 28.03 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.88 -41.34 78.48 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 120.163 1.347 . . . . 0.0 113.365 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -74.15 -36.43 3.33 Favored 'Trans proline' 0 C--N 1.354 0.86 0 CA-C-N 122.257 1.842 . . . . 0.0 113.613 169.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -66.81 -30.44 70.63 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.398 -1.439 . . . . 0.0 114.092 -175.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.4 m -69.09 -22.19 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 28.3 mt -79.2 -50.98 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.258 1.023 . . . . 0.0 109.581 170.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -59.05 -38.55 79.64 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.11 -29.98 68.17 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.002 0.819 . . . . 0.0 112.227 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.88 -47.58 44.77 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.168 -0.957 . . . . 0.0 112.505 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -28.27 67.49 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 120.333 1.424 . . . . 0.0 114.472 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -77.29 -24.68 50.93 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.051 1.501 . . . . 0.0 115.051 171.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -135.08 72.79 66.69 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.807 1.243 . . . . 0.0 111.892 172.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.76 -12.16 17.16 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.804 3.003 . . . . 0.0 117.182 -173.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.71 -20.6 39.08 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.6 1.16 . . . . 0.0 113.486 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 52.0 mmtt -65.8 157.55 30.06 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.845 0.858 . . . . 0.0 112.135 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 28.2 t30 -93.07 131.47 38.06 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.2 tp -47.66 -39.02 16.15 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.385 1.474 . . . . 0.0 114.685 -172.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.464 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.4 m-85 -79.72 -8.79 59.45 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 68.4 p -60.46 -26.7 66.97 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 120.596 -1.315 . . . . 0.0 110.976 167.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -73.41 -2.22 21.47 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.18 1.392 . . . . 0.0 113.53 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -81.72 -32.87 31.39 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.688 1.131 . . . . 0.0 111.783 167.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -67.27 -31.12 71.22 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.539 1.136 . . . . 0.0 112.269 -169.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -70.38 -28.05 64.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.592 1.957 . . . . 0.0 115.502 172.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -105.08 98.07 7.83 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.596 1.702 . . . . 0.0 115.596 -166.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 38.2 p -83.37 59.35 4.99 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.893 1.677 . . . . 0.0 111.272 169.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -72.53 96.12 1.9 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 -168.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 15.3 t70 61.79 -40.92 0.14 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 129.617 3.167 . . . . 0.0 118.021 172.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.16 152.61 95.9 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.073 1.349 . . . . 0.0 112.85 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.48 131.91 49.04 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.599 2.866 . . . . 0.0 113.703 179.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.708 1.603 . . . . 0.0 111.648 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.277 14.3 t-20 68.08 69.91 0.33 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.965 1.84 . . . . 0.0 112.668 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -119.09 154.22 33.55 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 130.075 3.35 . . . . 0.0 102.929 166.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.6 m -94.77 89.58 5.75 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 124.562 1.145 . . . . 0.0 112.345 -163.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.17 65.34 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 120.008 1.277 . . . . 0.0 111.014 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.42 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.2 mtmt -62.96 -20.72 65.52 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 127.16 2.184 . . . . 0.0 115.018 175.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -121.67 16.2 11.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.774 1.63 . . . . 0.0 111.778 177.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.3 ttm -61.77 117.73 6.23 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.53 155.04 36.48 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.162 -0.961 . . . . 0.0 109.499 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.18 -32.81 74.3 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.303 -1.498 . . . . 0.0 112.787 -172.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -62.84 -35.2 79.16 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 170.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -75.41 -37.88 60.21 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.826 1.251 . . . . 0.0 111.479 174.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -60.18 -50.69 72.67 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.531 -0.731 . . . . 0.0 112.241 177.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.5 pt -69.52 -1.19 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.547 1.139 . . . . 0.0 112.958 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -110.85 -10.87 14.41 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.728 1.611 . . . . 0.0 113.972 173.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 164.92 22.4 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.962 -1.086 . . . . 0.0 110.255 169.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.77 128.04 93.19 Favored Pre-proline 0 CA--C 1.556 1.196 0 O-C-N 120.84 -1.162 . . . . 0.0 112.219 -176.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -61.3 -7.26 8.06 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.788 3.658 . . . . 0.0 116.24 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 5.9 mptt -71.56 -59.29 2.83 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 127.072 2.149 . . . . 0.0 109.056 165.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.13 0.22 54.09 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 82.1 mtp -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 120.84 -1.162 . . . . 0.0 112.364 169.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.7 m -65.63 -51.18 51.82 Favored Pre-proline 0 N--CA 1.483 1.189 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.05 -45.62 39.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.179 2.586 . . . . 0.0 114.932 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.7 p -71.64 -31.88 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.605 -1.31 . . . . 0.0 113.419 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.1 -24.16 67.59 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.742 0.817 . . . . 0.0 111.485 171.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.439 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 74.0 t90 -85.09 -53.43 5.28 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.263 167.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -52.94 -34.48 55.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.075 0.94 . . . . 0.0 112.62 -172.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -69.62 -49.14 56.69 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.676 1.19 . . . . 0.0 112.259 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.95 -38.15 85.59 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.79 1.636 . . . . 0.0 111.813 -176.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -123.78 94.22 4.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.826 1.651 . . . . 0.0 110.409 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.68 152.66 38.46 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.813 0.845 . . . . 0.0 112.637 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -74.98 23.68 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.066 1.346 . . . . 0.0 114.29 -171.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 61.6 p -75.8 27.8 0.11 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.024 2.13 . . . . 0.0 113.596 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 71.9 t 61.8 147.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 129.408 3.083 . . . . 0.0 114.387 -175.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.26 139.09 40.98 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.846 -1.159 . . . . 0.0 112.412 -177.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -152.95 153.26 32.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.423 1.489 . . . . 0.0 112.275 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.12 13.53 64.69 Favored Glycine 0 CA--C 1.542 1.726 0 C-N-CA 124.121 0.867 . . . . 0.0 114.449 -175.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.41 178.23 32.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.869 2.176 . . . . 0.0 111.397 -170.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -134.04 4.82 3.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 m -83.0 69.95 9.91 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.596 -1.315 . . . . 0.0 111.658 -170.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.2 t -58.58 -29.51 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 125.708 1.603 . . . . 0.0 112.507 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.51 154.71 3.37 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.228 1.811 . . . . 0.0 113.164 169.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -66.19 126.19 27.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.527 -0.733 . . . . 0.0 110.435 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -89.57 167.19 13.15 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.484 1.914 . . . . 0.0 108.95 170.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.42 -28.97 69.03 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 119.874 -1.766 . . . . 0.0 113.255 -170.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.1 m -65.7 -41.96 91.73 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.443 -0.785 . . . . 0.0 110.849 168.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -63.94 -41.75 97.52 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.126 -0.984 . . . . 0.0 109.827 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.29 -24.99 67.85 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.08 0.952 . . . . 0.0 112.211 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.8 m -79.83 -32.19 40.6 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.46 1.104 . . . . 0.0 111.627 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -87.4 -28.7 21.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.577 1.08 . . . . 0.0 113.579 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.39 -41.97 79.27 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.185 173.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.41 -36.51 6.78 Favored 'Trans proline' 0 C--N 1.355 0.91 0 CA-C-N 122.382 1.886 . . . . 0.0 113.357 169.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -65.96 -35.62 81.08 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 120.317 -1.489 . . . . 0.0 113.565 -177.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.23 -21.43 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 174.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.6 mt -82.72 -51.37 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.901 0.88 . . . . 0.0 110.555 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.97 -43.21 73.3 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.043 0.937 . . . . 0.0 111.33 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -67.46 -30.05 69.67 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.918 -0.489 . . . . 0.0 111.732 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.5 m -74.41 -46.03 42.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.182 -0.913 . . . . 0.0 113.174 173.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -30.34 68.49 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.866 1.667 . . . . 0.0 114.453 177.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.252 20.4 pttt -79.21 -24.73 42.91 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 175.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -135.29 74.95 60.22 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 125.323 1.449 . . . . 0.0 112.522 169.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -59.53 -11.3 13.57 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.523 3.482 . . . . 0.0 117.176 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -80.15 -21.99 42.52 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.063 1.345 . . . . 0.0 113.369 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -69.43 159.22 33.63 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.861 1.264 . . . . 0.0 111.64 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.38 148.16 30.73 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.625 -0.672 . . . . 0.0 109.991 170.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.35 -33.55 75.76 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.27 -0.894 . . . . 0.0 112.666 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.42 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.7 m-85 -89.96 -24.66 21.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 117.007 2.225 . . . . 0.0 117.007 -169.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.8 t -60.0 -21.99 61.99 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.057 -1.027 . . . . 0.0 111.902 171.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -60.52 -7.44 2.14 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.944 -1.723 . . . . 0.0 113.709 171.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.7 tptt -66.9 -37.51 84.51 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.522 1.529 . . . . 0.0 112.258 167.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -29.88 71.03 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -167.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -85.29 -23.16 28.26 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.581 1.952 . . . . 0.0 115.848 -175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -121.74 12.18 10.58 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 118.501 2.778 . . . . 0.0 118.501 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.6 m -54.16 104.34 0.1 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 120.245 1.384 . . . . 0.0 113.921 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -101.98 -94.61 0.29 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.771 1.628 . . . . 0.0 114.837 -172.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.66 -26.37 62.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 116.339 1.977 . . . . 0.0 116.339 -166.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.57 153.1 81.02 Favored Pre-proline 0 CA--C 1.548 0.871 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -83.06 167.59 14.06 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.756 2.97 . . . . 0.0 111.023 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.165 1.386 . . . . 0.0 112.022 177.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.009 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 52.9 t30 54.68 63.97 1.97 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.799 1.64 . . . . 0.0 112.98 -175.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.43 ' HB3' ' HE3' ' A' ' 19' ' ' LYS 0.25 52.9 mm-40 -66.53 -6.53 15.32 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.873 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 72.7 m 108.0 84.47 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 130.595 3.558 . . . . 0.0 112.334 171.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.84 67.94 Favored 'General case' 0 CA--C 1.556 1.205 0 O-C-N 120.843 -1.161 . . . . 0.0 111.219 173.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.43 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 11.9 mtmt -63.42 -16.72 61.38 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 127.232 2.213 . . . . 0.0 116.601 173.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -121.2 9.32 10.43 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.866 1.266 . . . . 0.0 112.603 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.4 ttm -60.93 124.1 19.5 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.391 -0.818 . . . . 0.0 109.42 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -77.46 156.04 31.34 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.634 -0.667 . . . . 0.0 110.907 -177.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.41 -32.83 74.61 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.133 -1.604 . . . . 0.0 113.112 -173.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.78 -29.03 69.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.032 0.833 . . . . 0.0 112.611 171.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -84.25 -36.33 22.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.756 1.622 . . . . 0.0 111.313 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -62.26 -48.95 77.66 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.381 -0.824 . . . . 0.0 112.789 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.69 -6.3 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.816 0.847 . . . . 0.0 112.874 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.91 -11.57 15.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.314 1.846 . . . . 0.0 114.535 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.88 158.4 35.61 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.906 1.23 . . . . 0.0 110.845 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -66.38 131.03 94.22 Favored Pre-proline 0 N--CA 1.481 1.085 0 O-C-N 121.335 -0.853 . . . . 0.0 111.622 -176.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -60.9 -18.68 58.46 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.125 2.55 . . . . 0.0 114.566 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -55.34 -67.82 0.25 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.183 1.393 . . . . 0.0 109.85 168.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.02 -4.58 57.07 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 31.4 ttm -59.88 -41.04 90.69 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.04 -1.038 . . . . 0.0 112.032 168.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 67.5 m -56.04 -54.9 47.32 Favored Pre-proline 0 N--CA 1.484 1.229 0 CA-C-O 117.97 -1.014 . . . . 0.0 113.45 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.74 -53.82 5.04 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.02 3.147 . . . . 0.0 113.699 171.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.6 -31.91 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 119.448 -2.032 . . . . 0.0 113.306 -176.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.96 73.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.186 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' TRP . . . . . . . . . . . . 0.288 0.0 OUTLIER -86.37 -39.23 16.63 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 116.487 -1.72 . . . . 0.0 112.322 176.261 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' TRP . . . . . 0.439 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.4 m0 -62.26 -22.13 65.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 122.419 2.372 . . . . 0.0 113.022 173.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -77.47 -57.84 3.6 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.981 0.912 . . . . 0.0 111.873 168.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.32 -33.62 76.39 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.671 0.788 . . . . 0.0 112.271 -172.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -112.0 60.48 0.62 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.186 1.794 . . . . 0.0 111.274 170.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -49.24 154.67 0.8 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.005 1.322 . . . . 0.0 112.323 169.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 67.35 -25.96 0.12 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 127.309 2.243 . . . . 0.0 114.635 -169.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 8.4 p 62.54 -34.37 0.11 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 129.202 3.001 . . . . 0.0 117.0 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 85.5 t -71.21 122.23 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 125.919 1.688 . . . . 0.0 109.889 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.47 156.64 18.99 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -168.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -149.5 146.23 27.28 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.32 1.448 . . . . 0.0 111.799 -172.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.4 9.04 57.25 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 115.712 1.045 . . . . 0.0 115.712 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 169.23 -161.26 34.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.65 1.595 . . . . 0.0 112.42 -174.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -135.28 11.03 3.53 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 2.5 p -78.35 46.6 0.63 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.472 1.909 . . . . 0.0 114.557 -171.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 33.7 m -64.79 -23.61 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 124.769 1.228 . . . . 0.0 112.762 169.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.69 141.27 21.4 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.229 1.012 . . . . 0.0 110.739 169.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 19.7 mt -47.66 108.69 0.17 Allowed 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 118.843 0.747 . . . . 0.0 111.398 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -79.67 164.89 23.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.142 1.377 . . . . 0.0 109.772 176.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -64.96 -28.66 69.67 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.078 -1.639 . . . . 0.0 112.467 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.6 m -62.82 -42.38 99.7 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.482 -0.762 . . . . 0.0 110.801 168.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.49 -45.67 71.72 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.387 -0.82 . . . . 0.0 110.572 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 91.6 mt -57.14 -28.21 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.028 0.931 . . . . 0.0 112.389 173.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.5 m -80.8 -36.11 32.17 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.921 0.888 . . . . 0.0 112.013 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -81.95 -31.4 31.26 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.758 1.163 . . . . 0.0 114.058 -177.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.02 -39.68 72.62 Favored Pre-proline 0 CA--C 1.552 1.039 0 CA-C-N 120.07 1.305 . . . . 0.0 113.163 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -75.15 -36.37 2.51 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 122.388 1.889 . . . . 0.0 113.366 169.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -66.06 -29.74 70.14 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.395 -1.441 . . . . 0.0 113.908 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 32.3 m -69.38 -21.75 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 122.968 0.507 . . . . 0.0 112.327 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 10.3 mt -77.68 -50.7 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.327 1.051 . . . . 0.0 109.697 169.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.42 -39.57 87.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.293 0.637 . . . . 0.0 112.516 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.46 -27.46 65.24 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.019 0.827 . . . . 0.0 112.209 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.11 -50.11 20.93 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.453 -0.779 . . . . 0.0 112.319 175.608 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -27.32 68.4 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -79.05 -20.18 49.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 171.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -136.44 66.71 58.93 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.472 1.509 . . . . 0.0 110.52 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.23 -14.26 37.17 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 124.142 3.228 . . . . 0.0 116.494 -168.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.95 -24.72 48.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -62.62 157.96 19.42 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.937 1.295 . . . . 0.0 112.302 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -82.17 150.65 27.29 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.552 -0.717 . . . . 0.0 109.988 171.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.72 -41.18 99.04 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.293 -0.879 . . . . 0.0 113.15 176.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' TYR . . . . . 0.43 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.7 m-85 -82.41 -19.72 38.5 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -169.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 11.6 t -64.04 -15.01 58.5 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.793 -1.192 . . . . 0.0 112.197 169.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -67.87 -2.56 7.56 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 119.313 -2.117 . . . . 0.0 113.532 169.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -77.71 -30.81 51.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.69 1.132 . . . . 0.0 111.92 165.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -63.52 -33.38 75.45 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.919 1.288 . . . . 0.0 112.177 -169.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.94 -29.06 64.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.618 1.967 . . . . 0.0 115.346 170.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -98.77 105.26 17.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.408 1.483 . . . . 0.0 113.025 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.6 p -91.87 -6.08 52.17 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -84.2 16.95 2.7 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -72.87 1.81 7.97 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -146.38 149.91 39.21 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 128.051 2.54 . . . . 0.0 109.158 169.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.17 156.48 64.76 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.505 2.803 . . . . 0.0 112.664 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.189 0 C-N-CA 125.66 1.584 . . . . 0.0 110.995 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 . . . . . 0 CA--C 1.542 0.638 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.973 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.2 t 97.07 93.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 128.885 2.874 . . . . 0.0 117.422 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.53 -33.64 70.09 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 119.921 -1.737 . . . . 0.0 112.345 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 1.1 ptpt -73.85 -9.87 59.08 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 176.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -113.9 5.06 16.07 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.92 1.288 . . . . 0.0 112.468 168.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 29.0 ttm -60.57 127.31 31.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.957 1.253 . . . . 0.0 109.482 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -78.99 155.89 28.68 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.33 -35.75 78.26 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 120.338 -1.476 . . . . 0.0 112.801 -175.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -61.69 -32.47 72.67 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.668 0.787 . . . . 0.0 113.014 172.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -80.57 -36.84 32.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.115 1.366 . . . . 0.0 111.56 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.11 -48.57 81.13 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.532 -0.73 . . . . 0.0 112.327 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.2 pt -70.41 -2.04 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 124.318 1.047 . . . . 0.0 112.809 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -113.46 -15.08 12.66 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.973 1.709 . . . . 0.0 114.281 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 161.81 20.5 Favored 'General case' 0 CA--C 1.558 1.251 0 O-C-N 120.981 -1.074 . . . . 0.0 110.498 169.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.447 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 43.3 t-20 -63.92 132.53 95.28 Favored Pre-proline 0 N--CA 1.483 1.189 0 O-C-N 120.894 -1.129 . . . . 0.0 112.011 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 25.2 Cg_exo -62.22 -16.94 54.15 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.332 2.688 . . . . 0.0 114.831 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mptt -57.87 -62.81 1.54 Allowed 'General case' 0 C--N 1.351 0.657 0 C-N-CA 125.218 1.407 . . . . 0.0 108.829 167.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -77.56 -10.48 59.52 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 89.0 mtp -60.21 -37.68 81.02 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 120.905 -1.122 . . . . 0.0 112.937 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.4 m -61.22 -52.09 73.68 Favored Pre-proline 0 N--CA 1.485 1.295 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.444 ' HB3' ' CG ' ' B' ' 106' ' ' TRP . 38.2 Cg_endo -59.7 -41.79 52.34 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.772 2.315 . . . . 0.0 113.285 169.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 20' ' ' ALA . 87.9 t -56.73 -42.18 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 120.904 -1.123 . . . . 0.0 111.725 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.17 82.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.821 0.848 . . . . 0.0 111.556 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.436 ' HB3' ' CH2' ' B' ' 106' ' ' TRP . 0.0 OUTLIER -76.14 -36.69 58.68 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.882 1.219 . . . . 0.0 111.351 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.495 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -52.13 -41.95 62.95 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.976 1.262 . . . . 0.0 112.254 176.111 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -72.98 -53.31 11.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.795 1.638 . . . . 0.0 111.805 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 123.49 0.716 . . . . 0.0 112.237 -169.788 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 N--CA 1.464 0.246 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.23 -34.6 72.4 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.563 1.145 . . . . 0.0 111.904 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 98.4 m -71.98 -36.2 69.74 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.762 0.825 . . . . 0.0 111.189 174.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -79.49 -24.86 42.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.519 -178.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.77 -46.1 98.53 Favored Pre-proline 0 N--CA 1.481 1.092 0 CA-C-N 120.824 1.647 . . . . 0.0 112.535 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.25 -37.6 10.16 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.808 1.672 . . . . 0.0 113.3 170.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -66.08 -34.9 79.12 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.704 -1.247 . . . . 0.0 113.391 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.6 m -68.96 -17.17 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 118.965 0.802 . . . . 0.0 113.16 175.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -88.42 -52.44 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.369 1.068 . . . . 0.0 110.367 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -55.7 -47.82 76.17 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.292 1.037 . . . . 0.0 110.621 177.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -63.54 -25.24 68.16 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.43 -0.794 . . . . 0.0 112.106 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.17 -49.03 13.21 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.484 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.01 68.62 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 120.961 1.71 . . . . 0.0 113.966 174.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -71.22 -28.32 64.11 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 114.392 169.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.4 m-80 -135.37 66.57 65.89 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.982 1.313 . . . . 0.0 112.383 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -57.59 -15.68 21.28 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.591 2.861 . . . . 0.0 116.575 -173.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -82.6 -21.3 35.22 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.298 1.439 . . . . 0.0 113.523 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -71.62 160.37 32.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.694 1.197 . . . . 0.0 111.933 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -76.56 154.7 34.26 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.854 -0.529 . . . . 0.0 109.891 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -70.18 -38.42 75.37 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.264 -0.898 . . . . 0.0 113.103 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 1.4 m-85 -82.58 -21.96 35.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.0 t -60.11 -20.76 59.86 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.377 -0.827 . . . . 0.0 111.961 173.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -62.03 -5.07 1.93 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.586 -1.946 . . . . 0.0 114.074 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -33.77 74.13 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 119.806 1.184 . . . . 0.0 111.518 165.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -62.13 -31.93 72.46 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -167.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -74.78 -28.01 60.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.774 1.63 . . . . 0.0 115.129 176.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -166.281 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 103.69 -2.707 . . . . 0.0 103.69 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m -87.57 87.91 7.52 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 125.298 1.439 . . . . 0.0 113.285 -165.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.88 -38.57 56.59 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 120.383 1.447 . . . . 0.0 110.463 170.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -67.8 -7.03 24.28 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 127.686 2.394 . . . . 0.0 115.707 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -136.59 18.85 3.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.91 1.284 . . . . 0.0 112.482 174.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.9 ttm -59.48 120.92 10.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 168.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.0 t -73.77 153.79 39.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.107 -0.995 . . . . 0.0 109.552 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.71 -31.24 72.11 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.55 -1.344 . . . . 0.0 113.235 -172.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -65.84 -32.43 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.198 0.908 . . . . 0.0 113.121 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -76.5 -36.6 57.69 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.292 1.437 . . . . 0.0 111.115 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -63.79 -48.64 76.07 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.29 -0.881 . . . . 0.0 112.932 177.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.0 pt -69.63 -5.16 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 123.345 0.658 . . . . 0.0 112.697 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -103.47 -15.46 15.87 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.221 1.808 . . . . 0.0 114.23 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 158.86 31.72 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.9 1.227 . . . . 0.0 110.581 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.408 HD21 ' HD2' ' B' ' 98' ' ' LYS . 49.7 t-20 -66.4 132.05 94.29 Favored Pre-proline 0 N--CA 1.481 1.092 0 O-C-N 121.416 -0.802 . . . . 0.0 111.6 -174.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -56.95 -20.46 36.69 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.81 3.007 . . . . 0.0 115.379 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 96' ' ' ASN . 32.1 mttt -56.7 -64.12 0.98 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.996 1.719 . . . . 0.0 108.89 166.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.34 -12.15 59.1 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.0 ttm -57.02 -35.87 69.77 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.511 -1.368 . . . . 0.0 111.916 172.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.4 m -63.0 -54.92 42.25 Favored Pre-proline 0 N--CA 1.482 1.155 0 C-N-CA 124.319 1.047 . . . . 0.0 112.81 -177.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 102' ' ' PRO . . . . . 0.419 ' HG2' HG22 ' A' ' 24' ' ' VAL . 1.5 Cg_endo -50.1 -45.94 30.74 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.5 2.8 . . . . 0.0 113.685 168.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.64 -38.51 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.003 0.82 . . . . 0.0 111.838 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.63 90.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.576 0.751 . . . . 0.0 111.297 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CG ' ' CH2' ' A' ' 27' ' ' TRP . 89.5 t90 -67.35 -46.79 72.35 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.59 1.086 . . . . 0.0 110.243 167.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.444 ' CG ' ' HB3' ' A' ' 23' ' ' PRO . 0.6 OUTLIER -58.34 -33.28 69.36 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 123.427 1.584 . . . . 0.0 113.073 -168.942 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.3 tmm? -76.05 -42.59 47.11 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.234 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 108' ' ' LEU . . . . . 0.415 HD21 HG11 ' B' ' 133' ' ' VAL . 3.4 mm? . . . . . 0 CA--C 1.55 0.954 0 O-C-N 120.849 -1.157 . . . . 0.0 114.063 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.57 -30.06 64.94 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.183 -0.948 . . . . 0.0 112.706 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 68.0 m -80.39 -34.47 36.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.952 0.901 . . . . 0.0 111.949 174.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -79.63 -36.84 37.28 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 117.869 -1.062 . . . . 0.0 113.527 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -48.96 -46.3 74.68 Favored Pre-proline 0 N--CA 1.478 0.929 0 CA-C-N 120.238 1.381 . . . . 0.0 113.017 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.6 -38.21 6.24 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 CA-C-N 122.074 1.777 . . . . 0.0 113.448 171.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -64.81 -34.4 78.27 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.913 1.233 . . . . 0.0 113.367 -175.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 133' ' ' VAL . . . . . 0.415 HG11 HD21 ' B' ' 108' ' ' LEU . 20.8 m -75.48 -27.86 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.217 0.607 . . . . 0.0 112.575 177.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.9 mt -67.8 -47.24 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.09 -38.82 80.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.887 0.875 . . . . 0.0 112.316 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.49 -31.88 73.19 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.181 0.901 . . . . 0.0 112.149 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -72.14 -48.01 46.77 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.802 -1.186 . . . . 0.0 112.397 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -29.4 68.54 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.181 1.355 . . . . 0.0 114.502 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -79.32 -22.08 45.04 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 171.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.47 64.89 66.12 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 126.66 1.984 . . . . 0.0 110.45 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -64.22 -11.49 28.11 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.988 3.125 . . . . 0.0 115.881 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -81.42 -21.26 39.02 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.705 1.202 . . . . 0.0 113.387 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -68.03 159.03 31.6 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.838 0.855 . . . . 0.0 112.373 -173.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -83.9 127.91 34.18 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.7 tp -44.73 -38.86 4.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.03 -7.59 58.23 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 57.4 p -60.43 -30.15 69.45 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 120.579 -1.325 . . . . 0.0 111.125 167.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -69.54 -2.45 11.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.774 1.63 . . . . 0.0 113.533 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -38.38 53.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.159 0.983 . . . . 0.0 110.896 166.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -29.97 71.02 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -167.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -68.68 -27.78 66.28 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.661 1.984 . . . . 0.0 115.646 170.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.745 0 C-N-CA 125.11 1.364 . . . . 0.0 114.214 -167.537 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 . . . . . 0 N--CA 1.444 -0.744 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.0 t -102.75 92.93 4.82 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.895 1.278 . . . . 0.0 113.065 -165.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.58 68.45 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.418 -1.426 . . . . 0.0 111.329 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 5.6 ptpt -74.41 -7.22 52.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.241 1.816 . . . . 0.0 115.228 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -123.41 15.81 9.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.404 1.482 . . . . 0.0 111.95 168.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.1 ttm -61.86 118.63 7.46 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.829 -1.169 . . . . 0.0 108.446 171.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -76.64 155.35 33.51 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.059 -1.026 . . . . 0.0 109.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.84 -29.72 69.71 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 120.312 -1.492 . . . . 0.0 113.784 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -40.74 96.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.114 0.87 . . . . 0.0 111.804 169.34 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -66.86 -37.02 83.65 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.772 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -60.91 -52.99 62.68 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.39 -0.819 . . . . 0.0 112.299 177.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.04 -0.93 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.103 1.361 . . . . 0.0 112.785 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -107.16 -15.59 14.63 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.427 1.491 . . . . 0.0 113.61 172.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.38 164.56 22.67 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.076 -1.015 . . . . 0.0 110.522 169.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.487 HD21 ' HD3' ' A' ' 19' ' ' LYS . 52.7 t-20 -71.73 131.37 86.05 Favored Pre-proline 0 N--CA 1.484 1.233 0 O-C-N 120.867 -1.145 . . . . 0.0 112.411 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -18.37 23.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.557 3.505 . . . . 0.0 116.299 175.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.487 ' HD3' HD21 ' A' ' 17' ' ' ASN . 10.9 mttt -60.36 -58.19 9.55 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.304 1.842 . . . . 0.0 109.212 167.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.46 -2.68 58.78 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 75.4 mtp -63.18 -36.65 84.33 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.43 -1.419 . . . . 0.0 111.509 169.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.7 m -59.81 -52.25 75.08 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 124.776 1.231 . . . . 0.0 113.362 -177.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -53.19 -58.58 1.38 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.165 2.576 . . . . 0.0 113.94 167.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.4 p -63.48 -25.26 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 120.893 1.679 . . . . 0.0 113.294 -169.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.37 67.94 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 118.124 -0.941 . . . . 0.0 113.21 171.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 62.6 t90 -84.03 -55.34 4.27 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.176 1.353 . . . . 0.0 114.303 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.451 ' CD1' ' HB3' ' B' ' 102' ' ' PRO . 4.7 m95 -51.68 -40.28 59.79 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.886 0.85 . . . . 0.0 110.888 -173.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -58.57 -49.38 77.65 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.941 1.697 . . . . 0.0 111.934 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 C-N-CA 124.976 1.311 . . . . 0.0 113.755 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.468 0.45 0 CA-C-O 119.555 -0.259 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.47 -28.38 69.17 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.179 -0.951 . . . . 0.0 112.127 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 96.8 m -74.47 -38.41 62.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.39 0.676 . . . . 0.0 111.06 172.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -83.17 -32.21 26.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.121 -1.419 . . . . 0.0 114.033 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -46.64 -48.62 48.64 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-N 120.626 1.557 . . . . 0.0 112.77 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -36.3 30.01 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.376 2.051 . . . . 0.0 113.949 172.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -64.11 -34.19 77.47 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.833 -1.167 . . . . 0.0 112.977 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.09 -30.4 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.61 0.641 . . . . 0.0 111.692 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 mt -78.62 -51.17 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.506 0.722 . . . . 0.0 110.585 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.49 -39.3 87.2 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.646 0.778 . . . . 0.0 112.075 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -68.73 -31.05 69.84 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.305 0.642 . . . . 0.0 111.293 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.4 m -73.43 -46.04 50.86 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.086 -1.009 . . . . 0.0 113.223 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.42 68.77 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 121.032 1.742 . . . . 0.0 114.235 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -76.88 -33.79 57.81 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 174.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -132.4 77.56 69.96 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.631 1.172 . . . . 0.0 112.019 172.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -54.13 -11.78 3.07 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 124.972 3.781 . . . . 0.0 117.255 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -27.23 56.75 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.22 1.408 . . . . 0.0 112.527 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt -65.97 157.51 30.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.798 1.239 . . . . 0.0 112.493 -174.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -93.05 133.89 35.74 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 169.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.6 tp -49.81 -32.87 15.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.448 1.499 . . . . 0.0 114.175 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.1 m-85 -82.8 -10.76 58.72 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.2 p -60.61 -25.79 66.53 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.698 -1.252 . . . . 0.0 111.573 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -72.73 -0.08 12.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.723 1.609 . . . . 0.0 113.944 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.36 -34.18 25.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.649 1.579 . . . . 0.0 111.48 167.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -70.18 -28.8 65.6 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.045 1.338 . . . . 0.0 111.933 -170.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -71.88 -30.28 65.24 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.49 1.516 . . . . 0.0 115.008 175.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.568 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -166.294 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 97.63 99.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.891 2.876 . . . . 0.0 116.156 168.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.33 -30.9 67.06 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 120.083 -1.636 . . . . 0.0 111.774 169.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -67.08 -17.85 65.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.085 1.754 . . . . 0.0 115.292 174.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.57 6.29 14.57 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.596 1.158 . . . . 0.0 113.175 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.3 ttm -63.21 125.71 24.99 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.96 -1.087 . . . . 0.0 110.651 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -79.87 155.48 27.78 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.834 -1.166 . . . . 0.0 110.866 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.08 -35.36 78.43 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.116 -1.615 . . . . 0.0 112.862 -174.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.31 -29.42 70.5 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.182 0.901 . . . . 0.0 112.731 173.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -82.45 -35.58 27.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.719 1.608 . . . . 0.0 111.386 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -63.35 -48.55 77.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.789 0.835 . . . . 0.0 112.727 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -67.75 -4.52 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.785 0.834 . . . . 0.0 112.854 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.28 -11.03 15.66 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.487 1.915 . . . . 0.0 114.404 172.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 158.26 36.01 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.653 -1.279 . . . . 0.0 110.83 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -65.41 129.98 94.55 Favored Pre-proline 0 N--CA 1.478 0.941 0 O-C-N 121.207 -0.933 . . . . 0.0 111.534 -178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.75 -18.08 53.78 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.935 2.423 . . . . 0.0 114.808 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -54.5 -66.95 0.31 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.217 1.407 . . . . 0.0 109.521 168.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.55 -9.84 59.69 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.8 ttm -56.26 -43.44 78.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.871 0.868 . . . . 0.0 112.581 171.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 86.6 m -55.85 -54.73 48.75 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.019 -0.991 . . . . 0.0 113.655 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 102' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 7.4 Cg_endo -54.4 -54.2 5.01 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 124.438 3.425 . . . . 0.0 114.073 169.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.13 -31.39 52.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 119.667 -1.896 . . . . 0.0 113.338 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.27 71.16 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.399 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.407 ' HB3' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -86.83 -41.1 14.32 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 116.402 -1.761 . . . . 0.0 111.593 175.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.421 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 6.2 m0 -59.74 -22.95 62.77 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 123.356 2.798 . . . . 0.0 113.659 171.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.9 tmm? -76.97 -63.99 1.23 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.43 0.692 . . . . 0.0 111.092 167.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 C-N-CA 124.639 1.176 . . . . 0.0 113.842 -168.733 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 N--CA 1.47 0.544 0 CA-C-O 120.033 -0.032 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 92.0 mt -57.28 -28.35 62.92 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.523 0.729 . . . . 0.0 112.48 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 53.3 m -83.94 -34.69 24.41 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.607 1.163 . . . . 0.0 112.406 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -84.67 -33.34 23.23 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 117.608 -1.187 . . . . 0.0 113.751 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.33 -43.86 92.15 Favored Pre-proline 0 N--CA 1.481 1.11 0 CA-C-N 120.457 1.48 . . . . 0.0 112.871 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.46 -39.07 7.55 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 CA-C-N 122.389 1.889 . . . . 0.0 113.312 171.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.24 -33.91 77.1 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.776 1.171 . . . . 0.0 113.76 -174.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.32 -24.07 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.358 0.663 . . . . 0.0 112.355 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 27.5 mt -73.95 -49.78 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.607 0.763 . . . . 0.0 109.567 170.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -58.51 -41.56 85.7 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.957 0.903 . . . . 0.0 112.258 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.79 -26.16 65.96 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.167 -0.958 . . . . 0.0 112.302 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.2 -47.15 25.09 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.766 0.827 . . . . 0.0 112.215 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -26.86 68.14 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 120.268 1.394 . . . . 0.0 114.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.258 15.1 ptpt -84.13 -10.15 58.01 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.036 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -137.56 61.35 30.42 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 111.112 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.65 -14.16 34.19 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.877 3.051 . . . . 0.0 115.679 -168.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -85.57 -14.99 44.07 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 113.657 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -74.43 158.5 33.76 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.199 0.999 . . . . 0.0 111.765 -172.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -92.86 133.7 35.81 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.23 -40.05 46.42 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.914 1.285 . . . . 0.0 114.272 -169.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.257 5.0 m-85 -79.2 -6.84 57.53 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.9 p -61.97 -27.12 68.63 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.694 -1.254 . . . . 0.0 111.176 168.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -72.58 -3.66 26.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.04 1.336 . . . . 0.0 113.943 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -81.38 -29.46 34.01 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.374 0.988 . . . . 0.0 112.036 167.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -68.97 -32.12 71.47 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.747 0.819 . . . . 0.0 112.049 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -69.67 -28.43 65.86 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.16 1.784 . . . . 0.0 115.376 169.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -165.976 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.517 ' H ' ' HG2' ' B' ' 98' ' ' LYS . 15.0 m -134.48 56.76 1.83 Allowed 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 123.675 0.79 . . . . 0.0 110.248 169.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -52.76 -40.97 63.6 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 121.273 1.851 . . . . 0.0 111.475 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 3.3 ptpt -64.53 -11.04 30.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.511 2.324 . . . . 0.0 116.172 175.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -133.28 21.0 4.02 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.036 1.735 . . . . 0.0 111.727 171.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.477 ' HE1' ' HB2' ' B' ' 99' ' ' ALA . 19.3 ttm -62.13 122.65 16.08 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.6 t -76.96 153.97 34.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.08 -32.61 74.03 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 120.616 -1.302 . . . . 0.0 112.823 -173.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -62.96 -31.13 72.17 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.712 0.805 . . . . 0.0 112.971 170.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.73 -39.41 27.04 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.41 1.484 . . . . 0.0 111.851 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -58.71 -49.76 76.42 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.476 -0.765 . . . . 0.0 113.028 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -67.25 -4.44 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 C-N-CA 123.979 0.912 . . . . 0.0 112.668 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -112.94 -5.48 13.81 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.227 1.811 . . . . 0.0 113.813 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.424 HD22 ' HE1' ' A' ' 8' ' ' MET . 0.3 OUTLIER -75.81 161.98 28.55 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.897 -1.127 . . . . 0.0 110.382 173.618 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.439 HD21 ' HD3' ' A' ' 19' ' ' LYS . 45.2 t-20 -66.41 128.19 93.71 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 120.899 -1.126 . . . . 0.0 111.611 -174.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.4 -20.81 16.32 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.339 3.359 . . . . 0.0 115.879 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HD3' HD21 ' A' ' 17' ' ' ASN . 5.4 mptt -59.86 -67.07 0.42 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.181 1.792 . . . . 0.0 109.811 168.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.16 -5.29 57.53 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -177.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -60.79 -40.38 92.44 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.1 -1.0 . . . . 0.0 112.674 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.253 23.7 m -65.4 -52.11 47.79 Favored Pre-proline 0 N--CA 1.479 0.993 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -177.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.69 -42.85 42.19 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.558 2.839 . . . . 0.0 116.146 169.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.33 -37.44 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 119.913 1.233 . . . . 0.0 113.087 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.83 -28.62 68.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.781 0.832 . . . . 0.0 111.738 171.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.8 t90 -81.83 -53.77 5.91 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 117.693 -1.146 . . . . 0.0 112.406 170.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.43 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.0 t90 -64.12 -37.81 88.78 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 120.365 1.439 . . . . 0.0 111.281 -167.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -59.08 -31.23 68.71 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.746 1.218 . . . . 0.0 112.615 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 71.6 mt -64.63 -28.58 69.72 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.118 -0.989 . . . . 0.0 112.369 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 93.6 m -71.8 -41.68 67.98 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.534 0.734 . . . . 0.0 110.841 169.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -75.95 -33.32 59.8 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -175.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.253 1.6 mp -54.21 -41.94 91.27 Favored Pre-proline 0 CA--C 1.554 1.116 0 CA-C-N 119.694 1.134 . . . . 0.0 112.654 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.95 -36.81 5.57 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.193 1.929 . . . . 0.0 113.823 169.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -64.17 -33.43 75.77 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.16 1.345 . . . . 0.0 113.74 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.37 -23.53 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 118.773 0.715 . . . . 0.0 112.809 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.2 mt -80.02 -52.2 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.165 0.986 . . . . 0.0 110.189 173.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -54.33 -51.77 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.817 0.847 . . . . 0.0 110.489 175.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -64.73 -25.6 68.0 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.434 -0.791 . . . . 0.0 112.31 -178.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.83 -48.78 14.1 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.996 -1.002 . . . . 0.0 113.134 172.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -27.58 69.08 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 121.485 1.948 . . . . 0.0 113.851 174.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -70.22 -29.17 65.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.829 1.651 . . . . 0.0 114.032 168.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -133.91 69.91 74.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.706 1.202 . . . . 0.0 112.304 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -55.41 -16.57 14.13 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.232 2.621 . . . . 0.0 116.356 -176.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -85.65 -27.03 25.66 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -64.33 161.3 17.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.156 0.982 . . . . 0.0 112.661 -175.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -81.22 142.0 33.61 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.856 -0.527 . . . . 0.0 110.1 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.87 -35.81 69.33 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.018 0.927 . . . . 0.0 113.34 171.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.413 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -84.85 -28.25 26.18 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -171.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.2 t -62.48 -17.35 59.35 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.132 -0.98 . . . . 0.0 112.085 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -62.66 -6.63 3.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 119.722 -1.861 . . . . 0.0 113.929 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.09 72.5 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.239 1.416 . . . . 0.0 111.665 167.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -30.77 67.46 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -167.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -73.3 -30.16 63.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.814 1.246 . . . . 0.0 113.854 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.29 0 C-N-CA 124.449 1.1 . . . . 0.0 112.183 -167.68 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -92.97 95.59 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.752 -1.218 . . . . 0.0 113.786 -166.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.88 -36.77 59.61 Favored 'General case' 0 CA--C 1.558 1.277 0 O-C-N 121.16 -0.962 . . . . 0.0 109.932 168.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.408 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 25.2 mtmt -67.99 -12.71 61.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 128.89 2.876 . . . . 0.0 116.284 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -133.21 19.04 4.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.5 ttm -59.78 123.85 18.27 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 169.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -78.04 154.64 31.23 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.34 -0.85 . . . . 0.0 110.327 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.0 m -61.45 -35.09 76.63 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 120.482 -1.386 . . . . 0.0 112.596 -173.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -65.64 -32.33 73.85 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.306 0.957 . . . . 0.0 112.725 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -76.23 -37.83 57.18 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.03 1.332 . . . . 0.0 111.344 174.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -63.95 -49.43 72.6 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.944 0.898 . . . . 0.0 112.614 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.19 -2.99 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -110.79 -8.59 14.53 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.606 1.962 . . . . 0.0 114.089 172.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.6 156.89 35.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.747 1.158 . . . . 0.0 110.177 172.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -66.43 127.53 93.37 Favored Pre-proline 0 N--CA 1.479 0.986 0 O-C-N 121.3 -0.875 . . . . 0.0 109.662 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -46.77 -32.18 11.82 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.683 2.922 . . . . 0.0 113.819 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.517 ' HG2' ' H ' ' A' ' 4' ' ' SER . 57.8 mttt -60.11 -13.82 13.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 99' ' ' ALA . . . . . 0.477 ' HB2' ' HE1' ' A' ' 8' ' ' MET . . . -132.94 22.59 4.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 121.421 1.919 . . . . 0.0 113.123 165.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ttm -67.57 -54.77 17.11 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.677 1.191 . . . . 0.0 111.295 170.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.0 m -48.09 -55.7 17.04 Favored Pre-proline 0 N--CA 1.49 1.54 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.68 -45.42 40.49 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.124 3.216 . . . . 0.0 115.543 174.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.32 -39.99 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.391 1.451 . . . . 0.0 112.935 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.23 -31.86 71.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.185 0.594 . . . . 0.0 110.68 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 67.3 t90 -78.78 -48.61 14.49 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.541 172.322 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.41 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.7 t90 -64.67 -25.88 68.14 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 117.888 -1.525 . . . . 0.0 110.957 -171.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -62.0 -60.38 3.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.118 1.367 . . . . 0.0 111.17 167.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.67 0 C-N-CA 125.143 1.377 . . . . 0.0 113.423 -170.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.02 -30.44 61.88 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.1 m -81.91 -33.87 30.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.811 0.845 . . . . 0.0 112.347 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -83.17 -31.94 26.86 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.766 -1.112 . . . . 0.0 113.76 -177.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.82 -47.03 86.92 Favored Pre-proline 0 N--CA 1.481 1.1 0 CA-C-N 120.433 1.47 . . . . 0.0 113.038 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.31 -37.64 17.37 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 122.208 1.824 . . . . 0.0 113.318 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -65.42 -36.83 85.11 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.776 -1.203 . . . . 0.0 113.152 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 m -73.25 -28.44 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.777 -0.577 . . . . 0.0 112.49 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 49.7 mt -66.17 -49.23 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-N 118.191 0.45 . . . . 0.0 109.894 170.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.31 -41.61 80.24 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.406 0.683 . . . . 0.0 111.904 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -66.6 -27.53 67.78 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.517 -0.74 . . . . 0.0 112.923 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -76.07 -48.36 21.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.846 0.858 . . . . 0.0 112.184 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -26.47 68.28 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.979 1.263 . . . . 0.0 114.294 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.279 15.2 ptpt -83.73 -10.45 58.12 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 169.187 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -138.32 61.73 27.35 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.655 1.582 . . . . 0.0 111.439 174.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.81 -14.63 33.16 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.801 3.001 . . . . 0.0 115.847 -169.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -84.99 -14.54 47.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 113.681 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -77.33 160.09 29.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.681 1.192 . . . . 0.0 112.147 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -77.84 139.83 39.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.551 -0.718 . . . . 0.0 109.3 169.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -54.18 -35.76 62.66 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.089 0.956 . . . . 0.0 112.875 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.408 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -87.16 -23.03 24.96 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -170.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.1 t -64.24 -14.61 56.72 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 120.771 -1.206 . . . . 0.0 112.018 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -66.06 -5.17 8.87 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.487 -2.008 . . . . 0.0 114.18 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.01 -30.05 49.84 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 119.929 1.241 . . . . 0.0 111.565 166.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -64.98 -33.68 76.61 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.921 1.289 . . . . 0.0 112.037 -171.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -73.07 -28.8 62.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.528 1.931 . . . . 0.0 115.647 173.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -166.255 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.461 ' HB3' ' HE3' ' B' ' 98' ' ' LYS . 20.2 mm-40 . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 117.923 -1.037 . . . . 0.0 113.164 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 101.92 100.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 129.462 3.105 . . . . 0.0 114.919 168.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.73 -33.55 73.07 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.313 -1.492 . . . . 0.0 112.588 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.427 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.3 ptpt -74.31 -12.46 60.55 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -106.02 6.08 30.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.452 1.101 . . . . 0.0 112.594 168.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 43.0 ttm -62.02 129.31 40.3 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.724 -1.235 . . . . 0.0 109.722 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.88 155.12 27.92 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.049 -1.032 . . . . 0.0 110.481 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.88 -32.61 74.19 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.264 -1.522 . . . . 0.0 113.417 -175.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.86 -31.47 71.74 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -81.22 -35.0 31.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.39 1.476 . . . . 0.0 111.53 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -57.94 -50.45 73.31 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 121.562 -0.711 . . . . 0.0 112.658 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -69.57 -0.66 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 125.262 1.425 . . . . 0.0 113.042 177.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -111.54 -11.28 14.08 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.351 1.46 . . . . 0.0 114.318 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.42 165.99 24.04 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.188 -0.945 . . . . 0.0 111.622 174.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.423 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 49.9 t-20 -65.74 128.72 94.02 Favored Pre-proline 0 N--CA 1.483 1.191 0 O-C-N 120.941 -1.099 . . . . 0.0 112.542 -177.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 34.2 Cg_exo -57.65 -12.74 12.15 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.556 3.504 . . . . 0.0 116.521 177.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 9.3 mttt -65.75 -67.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.029 1.731 . . . . 0.0 109.672 166.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.64 -6.47 52.18 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 73.6 mtp -57.06 -30.74 64.53 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 121.009 -1.057 . . . . 0.0 112.155 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.267 23.7 m -68.15 -56.1 11.62 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.67 -36.62 82.09 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 123.173 2.582 . . . . 0.0 114.768 168.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.405 HG22 ' HG2' ' B' ' 102' ' ' PRO . 66.2 t -63.74 -53.97 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.504 0.593 . . . . 0.0 111.067 175.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.3 71.37 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.786 1.235 . . . . 0.0 111.685 -177.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.0 t90 -77.68 -52.74 8.49 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 117.575 -1.203 . . . . 0.0 113.459 169.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.494 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 3.0 t90 -66.44 -34.22 77.45 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.761 1.619 . . . . 0.0 111.886 -167.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 58.0 ttp -54.3 -44.2 71.78 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.958 0.903 . . . . 0.0 112.115 169.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.556 0 C-N-CA 125.281 1.432 . . . . 0.0 112.909 -171.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 CA--C 1.533 0.323 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.5 mt -64.24 -25.24 67.97 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.892 -1.13 . . . . 0.0 112.219 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.8 m -77.83 -35.49 51.11 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.701 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -88.49 -27.81 21.23 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.06 -43.64 85.18 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.913 174.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.69 -40.36 10.13 Favored 'Trans proline' 0 C--N 1.352 0.726 0 CA-C-N 122.16 1.807 . . . . 0.0 113.572 169.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -63.35 -37.23 86.48 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.954 1.252 . . . . 0.0 112.928 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 m -68.97 -28.38 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -72.31 -51.43 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 173.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.99 -43.09 77.31 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.141 0.977 . . . . 0.0 111.415 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.29 -30.49 69.51 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.831 -0.543 . . . . 0.0 111.375 -177.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.77 -42.7 57.67 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.11 -0.994 . . . . 0.0 112.807 174.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -31.08 68.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.764 1.62 . . . . 0.0 114.284 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -82.6 -25.71 32.97 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -130.9 73.95 80.5 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.767 1.627 . . . . 0.0 110.603 170.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.52 -11.45 16.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.731 3.621 . . . . 0.0 115.722 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -81.92 -25.14 35.18 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.806 1.642 . . . . 0.0 112.613 -175.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -66.41 154.61 39.69 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.114 0.966 . . . . 0.0 111.395 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -89.62 127.42 35.9 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 174.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.26 -51.5 10.77 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -166.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.427 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -70.92 -6.74 40.75 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.5 p -56.74 -28.21 60.69 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 120.75 -1.219 . . . . 0.0 110.969 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -71.16 -2.26 15.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.515 1.526 . . . . 0.0 114.307 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -83.41 -31.08 26.85 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 111.811 167.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -69.5 -28.69 66.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 111.94 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -75.63 -31.53 59.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.624 1.57 . . . . 0.0 114.988 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 112.425 -166.858 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.428 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 20.8 mm-40 . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m 117.99 78.91 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 130.885 3.674 . . . . 0.0 112.665 170.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.4 -39.37 70.11 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.156 -1.59 . . . . 0.0 111.905 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.444 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 2.3 ptpt -78.82 3.63 16.24 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -124.97 9.88 8.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.8 1.24 . . . . 0.0 112.2 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 37.6 ttm -61.5 124.7 21.37 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.476 1.034 . . . . 0.0 109.427 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -76.69 153.24 35.31 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.757 -0.589 . . . . 0.0 110.008 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.93 -28.27 68.16 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.323 -1.486 . . . . 0.0 113.88 -170.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -67.23 -31.85 72.48 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 118.806 0.73 . . . . 0.0 112.551 169.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -75.71 -37.96 59.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.004 1.322 . . . . 0.0 111.28 176.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -67.85 -4.83 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.99 -10.34 17.29 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.957 1.703 . . . . 0.0 113.886 172.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.67 157.77 37.4 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.81 1.187 . . . . 0.0 111.199 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.64 134.75 89.23 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 123.603 0.761 . . . . 0.0 113.036 -178.081 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -72.59 -7.19 20.42 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.719 1.612 . . . . 0.0 115.947 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' A' ' 3' ' ' GLU . 6.3 mptt -71.3 -53.79 13.05 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.926 1.694 . . . . 0.0 108.712 167.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.32 -15.6 54.92 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 36.3 ttm -54.03 -33.33 57.01 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.636 -0.665 . . . . 0.0 112.6 172.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 30.9 m -65.4 -58.24 12.59 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.773 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 102' ' ' PRO . . . . . 0.405 ' HG2' HG22 ' A' ' 24' ' ' VAL . 7.5 Cg_endo -51.79 -41.98 59.64 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 124.053 3.168 . . . . 0.0 115.033 172.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.92 -42.49 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.637 1.108 . . . . 0.0 113.034 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.69 -29.08 69.85 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.2 t90 -77.56 -51.9 9.93 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 117.728 -1.13 . . . . 0.0 112.16 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -65.84 -29.24 69.67 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.801 1.637 . . . . 0.0 111.21 -169.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 2.8 ttp -65.82 -39.25 90.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.726 1.61 . . . . 0.0 111.895 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 124.543 1.137 . . . . 0.0 112.43 -177.83 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 22.0 t70 . . . . . 0 CA--C 1.539 0.556 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 pp -62.05 -27.27 68.78 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 21.8 m -81.28 -31.49 33.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 122.502 0.321 . . . . 0.0 111.504 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -84.06 -26.1 29.31 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.389 -1.291 . . . . 0.0 114.472 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.16 -42.28 79.81 Favored Pre-proline 0 N--CA 1.482 1.15 0 CA-C-N 121.533 1.969 . . . . 0.0 113.983 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.44 -36.02 5.71 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 CA-C-N 122.487 1.924 . . . . 0.0 113.255 169.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -67.88 -30.78 70.23 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.697 -1.252 . . . . 0.0 113.923 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.0 m -70.9 -31.21 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.989 0.813 . . . . 0.0 111.431 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -68.15 -50.66 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 109.864 171.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -55.19 -44.65 75.48 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.852 0.861 . . . . 0.0 111.571 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.17 -37.03 84.64 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.458 1.026 . . . . 0.0 111.888 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.9 -36.66 78.31 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.456 -0.777 . . . . 0.0 112.189 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -58.3 -51.21 70.73 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.43 1.492 . . . . 0.0 112.648 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 pttt -84.87 -21.58 29.71 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -128.92 76.87 78.65 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.896 1.679 . . . . 0.0 109.672 170.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.09 -9.69 22.72 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.895 3.064 . . . . 0.0 114.957 -176.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -81.96 -21.44 37.2 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.312 1.445 . . . . 0.0 112.833 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -70.37 159.65 33.75 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.441 1.097 . . . . 0.0 111.992 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -92.66 130.26 38.35 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 169.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 65.6 tp -45.33 -47.41 13.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.999 1.32 . . . . 0.0 114.244 -172.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.444 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -72.53 -8.76 56.79 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -174.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 70.3 p -60.53 -24.53 65.44 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.677 -1.264 . . . . 0.0 111.61 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -72.43 -1.18 14.7 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.831 1.253 . . . . 0.0 114.26 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -80.73 -31.85 35.89 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.663 1.12 . . . . 0.0 111.572 165.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -68.75 -29.05 67.37 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.709 1.204 . . . . 0.0 112.465 -169.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.94 -30.01 68.37 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 114.115 169.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.566 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -168.935 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 . . . . . 0 CA--C 1.544 0.729 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.5 m 90.69 99.76 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 129.685 3.194 . . . . 0.0 117.808 165.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.99 -32.4 66.06 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 119.87 -1.769 . . . . 0.0 111.861 169.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 32.0 mttt -58.92 -22.81 60.44 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 126.989 2.116 . . . . 0.0 114.86 175.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -119.29 6.01 11.2 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.895 1.678 . . . . 0.0 112.756 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -61.84 127.41 31.27 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.924 -1.11 . . . . 0.0 109.755 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.58 155.19 28.26 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.292 -0.88 . . . . 0.0 110.022 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.39 -33.84 76.43 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 120.454 -1.404 . . . . 0.0 113.187 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -64.09 -32.24 73.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.774 0.716 . . . . 0.0 112.881 172.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -77.22 -38.18 51.79 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.885 1.274 . . . . 0.0 111.836 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -59.09 -50.37 74.31 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.818 0.847 . . . . 0.0 112.438 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.1 pt -68.36 -5.07 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 124.454 1.102 . . . . 0.0 112.925 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -105.75 -8.98 17.5 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.735 1.614 . . . . 0.0 113.543 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.14 157.89 33.94 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 119.758 1.163 . . . . 0.0 110.462 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -66.83 129.74 94.03 Favored Pre-proline 0 N--CA 1.482 1.132 0 O-C-N 121.216 -0.927 . . . . 0.0 111.426 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -52.17 -27.82 31.18 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.385 2.723 . . . . 0.0 115.019 177.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -51.32 -66.5 0.37 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.769 1.628 . . . . 0.0 111.078 170.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.255 . . -83.07 -4.55 58.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 178.074 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.2 ttt -64.65 -36.55 84.61 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.857 -1.152 . . . . 0.0 112.211 168.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.9 m -60.45 -51.83 77.22 Favored Pre-proline 0 N--CA 1.478 0.939 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.4 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 10.0 Cg_endo -54.94 -46.3 34.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.16 2.573 . . . . 0.0 115.309 169.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.96 -35.52 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 119.765 1.166 . . . . 0.0 113.154 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.12 -18.34 64.33 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.45 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.2 t90 -95.69 -48.6 5.72 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.181 0.901 . . . . 0.0 111.665 168.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.512 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 56.6 t-105 -64.24 -34.58 78.43 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.563 1.145 . . . . 0.0 111.922 -170.253 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.2 tmm? -67.18 -46.78 72.93 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 124.831 1.252 . . . . 0.0 111.385 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 124.775 1.23 . . . . 0.0 112.749 -169.288 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.1 -27.37 69.35 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.056 -1.027 . . . . 0.0 112.436 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.0 m -76.39 -35.39 58.65 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.405 1.082 . . . . 0.0 111.615 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.53 -28.17 31.21 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.453 1.024 . . . . 0.0 113.642 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.256 1.5 mp -52.93 -40.68 80.45 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.301 1.41 . . . . 0.0 113.628 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.44 -37.01 3.47 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 122.225 1.83 . . . . 0.0 113.175 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -64.57 -34.3 77.94 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.302 -1.499 . . . . 0.0 113.65 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.74 -15.85 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 174.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.0 mt -91.38 -51.27 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.456 1.102 . . . . 0.0 110.663 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.5 -48.39 71.92 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.942 0.897 . . . . 0.0 110.321 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -65.26 -23.57 67.08 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.282 -0.886 . . . . 0.0 112.62 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.7 -48.42 13.7 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.309 0.959 . . . . 0.0 112.668 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.8 -27.17 69.0 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 120.851 1.66 . . . . 0.0 113.892 174.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -72.5 -31.0 65.01 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.67 1.588 . . . . 0.0 114.884 169.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -130.81 64.52 73.84 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.173 1.389 . . . . 0.0 111.369 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -59.51 -14.87 27.54 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 124.267 3.311 . . . . 0.0 115.726 -172.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -84.61 -20.85 30.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.604 1.562 . . . . 0.0 113.797 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -73.46 162.27 29.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.993 1.317 . . . . 0.0 112.248 -172.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -77.68 154.1 32.45 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.923 -0.486 . . . . 0.0 110.04 169.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.36 -36.7 77.1 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.28 -0.887 . . . . 0.0 113.382 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.3 m-85 -88.05 -21.09 24.95 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 -168.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.3 t -59.16 -22.17 60.53 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.285 -0.884 . . . . 0.0 111.549 170.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -58.67 -16.46 16.4 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 119.555 -1.966 . . . . 0.0 113.394 171.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -58.07 -34.57 70.27 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.31 0.959 . . . . 0.0 112.473 167.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -25.6 67.98 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.962 0.887 . . . . 0.0 112.303 -169.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.344 2.258 . . . . 0.0 113.616 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.738 0 C-N-CA 125.083 1.353 . . . . 0.0 112.731 -166.932 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.321 33.3 mm-40 . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 70.7 m 107.48 79.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 131.205 3.802 . . . . 0.0 114.017 167.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.7 -41.49 61.49 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 121.068 -1.02 . . . . 0.0 110.837 172.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.443 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 13.8 mtmt -63.19 -15.1 55.86 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.299 2.239 . . . . 0.0 115.809 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -123.85 7.72 8.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.456 1.502 . . . . 0.0 112.799 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 31.0 ttm -59.6 125.25 22.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.765 1.166 . . . . 0.0 109.353 174.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.56 153.76 33.03 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 -178.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.93 -32.49 73.79 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.427 -1.421 . . . . 0.0 112.8 -173.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -66.52 -30.88 71.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.968 0.804 . . . . 0.0 112.89 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -77.5 -38.69 48.51 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.794 1.238 . . . . 0.0 111.315 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.76 -51.27 70.46 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.486 0.714 . . . . 0.0 112.316 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.2 pt -68.27 -3.29 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.832 0.853 . . . . 0.0 112.861 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -105.72 -9.12 17.45 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 126.053 1.741 . . . . 0.0 114.112 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.57 158.13 36.76 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.828 1.195 . . . . 0.0 111.065 174.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.408 HD21 ' HD2' ' B' ' 98' ' ' LYS . 49.0 t-20 -67.82 132.49 92.39 Favored Pre-proline 0 N--CA 1.485 1.283 0 O-C-N 121.04 -1.037 . . . . 0.0 112.128 -173.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -57.29 -16.91 24.15 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.829 3.019 . . . . 0.0 115.829 175.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.2 mttt -61.89 -64.11 1.04 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.0 1.72 . . . . 0.0 109.458 166.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.2 -4.18 56.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -177.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.8 mmt -52.42 -45.42 65.93 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.61 1.096 . . . . 0.0 111.704 168.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 83.3 m -60.88 -52.8 69.74 Favored Pre-proline 0 N--CA 1.48 1.05 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.877 -172.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -49.87 -49.46 15.96 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.232 3.288 . . . . 0.0 115.202 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.2 p -72.4 -36.41 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 119.485 1.039 . . . . 0.0 112.934 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.98 67.43 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.518 1.127 . . . . 0.0 111.35 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.523 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.6 t90 -84.21 -53.83 5.23 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 117.826 -1.083 . . . . 0.0 110.883 166.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.523 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.9 t90 -62.29 -33.03 73.87 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 116.495 -2.082 . . . . 0.0 113.159 -164.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -59.72 -42.57 93.38 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.225 1.01 . . . . 0.0 112.635 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.545 0.763 0 C-N-CA 126.525 1.93 . . . . 0.0 112.435 -172.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 . . . . . 0 N--CA 1.468 0.442 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -56.32 -30.18 62.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.385 0.674 . . . . 0.0 112.259 173.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.6 m -79.7 -39.4 31.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.222 1.009 . . . . 0.0 112.092 172.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -70.89 -36.67 72.85 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.512 -1.368 . . . . 0.0 113.545 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.97 -41.95 90.66 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.592 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -76.0 -35.47 2.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.094 1.863 . . . . 0.0 113.653 169.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -67.22 -28.05 67.74 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.189 -1.569 . . . . 0.0 114.166 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.1 m -71.2 -24.72 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.843 -0.536 . . . . 0.0 112.035 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 36.7 mt -74.22 -47.95 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.196 0.999 . . . . 0.0 109.965 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -54.65 -48.27 72.51 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.745 0.818 . . . . 0.0 112.029 172.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -68.0 -24.74 65.16 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.792 -1.193 . . . . 0.0 112.151 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -76.54 -47.67 21.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 118.422 -0.799 . . . . 0.0 112.626 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 120.826 1.648 . . . . 0.0 114.047 176.144 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -69.45 -30.37 68.27 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 167.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -133.7 64.79 69.11 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.975 1.31 . . . . 0.0 112.395 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -58.7 -16.73 32.16 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.101 2.534 . . . . 0.0 116.704 -170.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -83.24 -15.02 51.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.998 1.319 . . . . 0.0 113.347 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.04 162.36 28.11 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.891 1.277 . . . . 0.0 112.007 -172.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -76.98 157.09 31.45 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -73.0 -48.45 36.23 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 174.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.443 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.1 m-85 -77.86 -18.06 56.66 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 116.161 1.911 . . . . 0.0 116.161 -168.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.2 t -58.88 -24.2 61.93 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.383 -0.823 . . . . 0.0 111.686 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -61.51 -4.1 1.22 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 119.787 -1.82 . . . . 0.0 114.242 171.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -71.21 -31.92 68.17 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.705 1.139 . . . . 0.0 112.168 166.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -63.11 -34.13 76.95 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -168.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -70.13 -26.27 63.87 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.824 2.05 . . . . 0.0 114.766 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.635 0 C-N-CA 125.432 1.493 . . . . 0.0 113.204 -168.338 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t 80.26 117.5 0.06 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.601 2.761 . . . . 0.0 117.439 167.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.16 -25.41 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.314 -0.866 . . . . 0.0 113.17 175.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -59.82 -30.26 68.8 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.603 1.561 . . . . 0.0 113.097 177.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -107.6 4.62 26.12 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.062 1.745 . . . . 0.0 113.144 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.1 ttm -64.62 124.84 22.93 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.855 -1.153 . . . . 0.0 110.374 175.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.81 155.68 27.75 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.013 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -62.35 -34.38 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.57 -1.331 . . . . 0.0 112.898 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -60.47 -32.03 71.02 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 171.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -82.37 -37.63 25.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.265 1.426 . . . . 0.0 111.602 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.42 -48.39 81.84 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.641 0.777 . . . . 0.0 112.61 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -68.27 -3.66 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 124.18 0.992 . . . . 0.0 112.618 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -111.99 -4.8 14.41 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 125.627 1.571 . . . . 0.0 114.148 176.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.78 159.44 32.92 Favored 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.78 -1.2 . . . . 0.0 111.389 177.136 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -54.01 134.02 58.5 Favored Pre-proline 0 N--CA 1.484 1.227 0 C-N-CA 124.81 1.244 . . . . 0.0 113.8 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.48 -15.49 41.8 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.085 2.523 . . . . 0.0 116.223 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HB2' ' HE2' ' B' ' 87' ' ' MET . 7.2 mptt -71.08 -55.51 8.08 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 120.759 1.618 . . . . 0.0 109.331 170.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.44 -0.18 48.95 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -175.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.76 -40.42 95.08 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.256 23.2 m -66.94 -50.95 40.36 Favored Pre-proline 0 N--CA 1.481 1.093 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -175.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.1 -42.13 47.02 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.607 2.871 . . . . 0.0 115.538 169.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.2 p -73.64 -40.75 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.432 1.014 . . . . 0.0 113.241 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.75 66.65 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.754 0.822 . . . . 0.0 111.494 174.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.494 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 76.7 t90 -87.97 -50.48 6.39 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.05 -1.452 . . . . 0.0 112.104 168.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.42 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 2.0 t90 -67.62 -26.9 66.47 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 121.685 2.039 . . . . 0.0 112.12 -168.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.41 -43.01 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.663 0.785 . . . . 0.0 111.777 169.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 125.812 1.645 . . . . 0.0 111.766 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.221 -0.442 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.02 -21.52 66.54 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 120.969 -1.082 . . . . 0.0 112.207 177.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.4 m -81.48 -37.42 27.95 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.987 0.915 . . . . 0.0 111.438 169.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -83.74 -28.07 28.48 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.776 1.171 . . . . 0.0 113.864 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.27 -42.88 96.22 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 119.985 1.266 . . . . 0.0 112.152 176.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.53 -35.5 10.3 Favored 'Trans proline' 0 C--N 1.353 0.788 0 CA-C-N 122.145 1.802 . . . . 0.0 113.269 169.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -66.1 -36.33 82.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.109 -1.62 . . . . 0.0 113.671 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.12 -20.78 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.798 0.727 . . . . 0.0 112.573 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 39.3 mt -82.34 -50.67 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.062 0.945 . . . . 0.0 110.558 171.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.25 -38.71 77.43 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 123.853 0.861 . . . . 0.0 111.9 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -69.41 -29.09 66.75 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.954 0.502 . . . . 0.0 111.601 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.6 m -77.19 -46.27 23.88 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.922 174.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -29.47 68.41 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.974 1.716 . . . . 0.0 114.159 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -75.64 -29.08 59.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -134.66 74.63 64.67 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.971 1.309 . . . . 0.0 111.871 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -58.37 -12.44 13.56 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.442 3.428 . . . . 0.0 117.445 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -79.63 -23.95 42.25 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.884 1.273 . . . . 0.0 113.401 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt -64.85 154.66 36.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.37 1.068 . . . . 0.0 112.085 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -80.99 151.58 28.39 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.427 -0.796 . . . . 0.0 109.622 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.0 tp -66.33 -36.55 83.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.86 -1.15 . . . . 0.0 113.132 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.45 -20.94 30.93 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -64.27 -14.54 56.47 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.214 -0.929 . . . . 0.0 112.288 169.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -66.78 -3.52 6.95 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 119.156 -2.215 . . . . 0.0 113.906 169.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -32.77 56.18 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.71 1.204 . . . . 0.0 111.199 165.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -65.69 -29.93 70.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.69 1.596 . . . . 0.0 112.279 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -74.24 -29.61 61.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.579 1.552 . . . . 0.0 114.765 174.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 124.927 1.291 . . . . 0.0 113.767 -167.719 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 . . . . . 0 N--CA 1.443 -0.784 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 69.5 m -86.43 91.78 8.63 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.808 1.643 . . . . 0.0 113.378 -165.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.91 -35.67 64.39 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 120.385 -1.447 . . . . 0.0 110.789 170.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.475 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 18.2 mtmt -76.5 -4.33 42.09 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.303 2.241 . . . . 0.0 115.942 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -134.72 17.26 3.58 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.719 1.208 . . . . 0.0 112.207 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' MET . . . . . 0.457 ' HE2' ' HB2' ' A' ' 19' ' ' LYS . 58.6 ttm -59.63 134.44 57.02 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 121.292 -0.88 . . . . 0.0 108.711 170.186 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -72.02 166.94 21.2 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.468 1.128 . . . . 0.0 112.176 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.69 -31.27 68.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.212 170.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -65.45 -38.36 89.61 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.055 0.843 . . . . 0.0 112.397 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -68.76 -41.57 78.7 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 121.459 -0.776 . . . . 0.0 112.094 172.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -59.46 -47.71 84.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.616 0.644 . . . . 0.0 111.947 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -71.27 -13.26 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.676 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.46 -24.42 20.71 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.467 1.031 . . . . 0.0 113.547 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.03 155.47 36.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.38 1.072 . . . . 0.0 112.139 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -75.16 139.4 72.45 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -65.58 -16.5 54.0 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 121.918 1.745 . . . . 0.0 116.238 -172.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -60.08 -61.11 2.85 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.672 -1.268 . . . . 0.0 110.46 168.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.1 -8.99 57.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -177.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -57.31 -40.66 78.35 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.02 -1.05 . . . . 0.0 110.911 168.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.5 m -57.87 -57.77 23.3 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.39 1.076 . . . . 0.0 113.113 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.78 -40.54 79.73 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 124.12 3.213 . . . . 0.0 115.791 172.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -76.8 -36.56 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 CA-C-N 120.717 1.599 . . . . 0.0 113.355 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.02 -29.48 69.74 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.755 0.822 . . . . 0.0 111.03 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.518 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 67.5 t90 -80.06 -53.05 7.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 117.869 -1.062 . . . . 0.0 112.772 169.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.518 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.17 -30.05 70.44 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 117.909 -1.516 . . . . 0.0 111.305 -168.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -58.56 -34.5 71.12 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.705 0.802 . . . . 0.0 112.896 171.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mm? . . . . . 0 CA--C 1.548 0.873 0 C-N-CA 126.442 1.897 . . . . 0.0 114.468 178.615 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.2 mt -56.83 -31.53 64.83 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.812 0.845 . . . . 0.0 112.544 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 38.1 m -80.71 -35.98 32.82 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.928 0.891 . . . . 0.0 112.144 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -81.73 -30.01 32.66 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.93 -40.51 72.4 Favored Pre-proline 0 CA--C 1.555 1.148 0 CA-C-N 120.525 1.511 . . . . 0.0 113.723 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -74.05 -37.46 2.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 CA-C-N 122.067 1.774 . . . . 0.0 113.632 169.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -67.68 -30.27 69.75 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 120.372 -1.455 . . . . 0.0 114.181 -174.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -67.64 -24.22 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.584 . . . . 0.0 112.379 173.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 48.9 mt -72.87 -53.16 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.209 1.004 . . . . 0.0 109.734 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -55.26 -53.74 52.24 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.469 0.707 . . . . 0.0 110.967 176.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.81 -24.96 67.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.191 -0.943 . . . . 0.0 112.816 -177.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -78.82 -47.62 16.31 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.648 1.113 . . . . 0.0 112.314 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -25.28 67.94 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 120.93 1.695 . . . . 0.0 113.463 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -74.81 -26.85 60.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.455 1.502 . . . . 0.0 114.959 169.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -135.85 62.49 47.39 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.331 1.453 . . . . 0.0 110.871 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.47 -16.0 39.42 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.577 2.851 . . . . 0.0 114.773 -171.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -78.39 -23.88 46.58 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.973 1.709 . . . . 0.0 114.283 -177.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -67.1 164.42 18.0 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.27 1.428 . . . . 0.0 112.901 -173.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.37 131.04 37.12 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 168.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.6 tp -46.03 -37.99 7.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.739 1.616 . . . . 0.0 113.728 179.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 7.2 m-85 -78.31 -8.64 58.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.0 p -65.44 -24.3 67.15 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 120.786 -1.197 . . . . 0.0 111.636 168.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -72.97 -2.48 21.18 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -80.04 -32.11 39.51 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.663 1.12 . . . . 0.0 111.632 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -68.33 -30.85 69.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.744 0.818 . . . . 0.0 112.078 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -73.34 -28.56 62.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.258 1.823 . . . . 0.0 115.253 169.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 125.189 1.395 . . . . 0.0 114.021 -165.773 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.407 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 19.8 mm-40 . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.201 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 t 100.24 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.261 3.024 . . . . 0.0 115.138 169.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.79 -26.28 68.56 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.073 -1.642 . . . . 0.0 111.01 169.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HD3' ' CE1' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -67.15 -20.26 65.72 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.961 2.104 . . . . 0.0 113.782 175.452 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -115.58 5.2 14.31 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.937 1.295 . . . . 0.0 113.29 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.1 ttm -62.62 123.24 17.84 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.017 -1.052 . . . . 0.0 109.977 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -79.17 155.4 28.67 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.227 -0.921 . . . . 0.0 110.695 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.11 -34.97 75.8 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.604 -1.31 . . . . 0.0 112.831 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -61.62 -33.38 73.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.95 0.796 . . . . 0.0 112.95 172.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -78.63 -37.36 42.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.994 1.318 . . . . 0.0 111.607 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.81 -49.64 76.91 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.613 0.765 . . . . 0.0 112.409 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.6 pt -68.38 -5.87 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.324 1.05 . . . . 0.0 112.896 177.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -105.16 -8.84 18.13 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.412 1.485 . . . . 0.0 113.494 174.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.36 159.87 31.8 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 120.957 -1.089 . . . . 0.0 111.203 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -67.64 130.08 93.23 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.039 -1.038 . . . . 0.0 112.187 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.79 -16.99 12.48 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.809 3.673 . . . . 0.0 116.396 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HG3' ' C ' ' B' ' 82' ' ' GLU . 11.9 mttt -64.4 -67.62 0.42 Allowed 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.813 2.045 . . . . 0.0 108.649 166.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.84 -10.45 59.51 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.38 -34.91 73.0 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.272 19.1 m -66.3 -52.65 36.24 Favored Pre-proline 0 N--CA 1.481 1.081 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -50.98 -43.95 44.81 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.368 2.712 . . . . 0.0 115.469 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.3 p -73.04 -38.45 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-N 119.218 0.917 . . . . 0.0 113.095 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.21 -20.51 66.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.254 1.022 . . . . 0.0 111.783 174.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.474 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 58.4 t90 -88.65 -51.2 5.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.81 168.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.426 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 1.9 t90 -69.2 -31.08 69.44 Favored 'General case' 0 C--N 1.351 0.63 0 CA-C-N 120.025 1.284 . . . . 0.0 112.252 -168.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -63.92 -43.84 94.7 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.625 0.77 . . . . 0.0 110.995 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 CA--C 1.542 0.652 0 C-N-CA 124.592 1.157 . . . . 0.0 112.802 -173.208 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.465 0.324 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.07 -22.3 66.94 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.129 -0.982 . . . . 0.0 111.812 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.9 m -79.17 -36.87 39.66 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.172 0.989 . . . . 0.0 111.67 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -82.65 -33.59 27.74 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.551 -1.343 . . . . 0.0 113.876 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.43 -42.38 87.28 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.696 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.41 -37.93 7.0 Favored 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 122.119 1.793 . . . . 0.0 113.385 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -67.02 -34.45 77.75 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.149 -1.594 . . . . 0.0 113.68 -176.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.6 m -67.52 -16.2 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 173.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.7 mt -90.58 -50.73 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.221 1.408 . . . . 0.0 110.687 172.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.28 -39.14 78.46 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.309 1.043 . . . . 0.0 111.482 177.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -70.14 -24.29 63.15 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.14 -0.975 . . . . 0.0 111.52 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.82 -44.8 17.91 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.999 0.92 . . . . 0.0 112.031 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -27.69 69.37 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 120.666 1.575 . . . . 0.0 113.526 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -69.56 -35.12 75.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 168.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -130.04 65.78 76.21 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.682 1.193 . . . . 0.0 112.263 -178.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -55.71 -14.43 10.43 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.53 2.82 . . . . 0.0 117.033 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -84.85 -21.41 29.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.375 1.47 . . . . 0.0 113.65 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -70.07 158.32 35.92 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.327 1.051 . . . . 0.0 111.981 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -94.91 133.37 38.72 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.4 tp -49.64 -42.81 46.07 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -168.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CE1' ' HD3' ' A' ' 6' ' ' LYS . 7.5 m-85 -75.0 -8.56 56.86 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -178.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 69.0 p -60.41 -27.37 67.4 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.349 -1.47 . . . . 0.0 111.517 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -72.87 -3.85 28.22 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.76 1.224 . . . . 0.0 113.7 177.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -79.73 -30.95 41.05 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.338 0.972 . . . . 0.0 111.747 168.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -69.71 -26.03 64.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.72 1.208 . . . . 0.0 112.243 -170.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -76.88 -31.82 57.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.843 1.657 . . . . 0.0 114.872 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.503 0 C-N-CA 124.304 1.042 . . . . 0.0 113.658 -167.705 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.407 ' C ' ' HG3' ' A' ' 19' ' ' LYS . 34.9 mm-40 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.1 t 101.62 95.09 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.68 3.192 . . . . 0.0 116.305 168.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.22 -37.39 77.38 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.339 -1.476 . . . . 0.0 112.202 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.3 ptpt -76.01 -13.22 60.23 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -107.92 7.26 27.91 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.656 1.183 . . . . 0.0 113.051 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 40.5 ttm -62.55 128.66 37.02 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.795 -1.19 . . . . 0.0 109.829 173.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -77.17 154.55 33.04 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 120.929 -1.107 . . . . 0.0 110.744 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.16 -33.67 74.95 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.225 -1.547 . . . . 0.0 113.277 -174.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -30.79 71.15 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 119.171 0.896 . . . . 0.0 112.22 173.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -76.54 -37.23 56.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.677 1.191 . . . . 0.0 111.504 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.25 -49.63 76.33 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.418 -0.801 . . . . 0.0 113.022 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 9.0 pt -66.61 -8.86 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -102.08 -12.14 18.33 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.114 1.766 . . . . 0.0 114.015 173.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.51 157.73 37.35 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.616 1.098 . . . . 0.0 111.45 176.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.449 HD21 ' CD ' ' B' ' 98' ' ' LYS . 1.7 t-20 -57.51 134.66 82.06 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.421 1.088 . . . . 0.0 113.458 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 97' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 13.6 Cg_exo -75.92 -6.32 17.3 Favored 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 121.483 1.456 . . . . 0.0 115.176 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.449 ' CD ' HD21 ' B' ' 96' ' ' ASN . 6.3 mptt -70.04 -55.28 9.94 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.454 1.479 . . . . 0.0 109.207 168.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.72 -9.61 55.53 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -178.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.2 ttm -56.06 -30.91 62.64 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 120.243 -1.536 . . . . 0.0 112.731 169.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.7 m -66.05 -57.2 13.96 Favored Pre-proline 0 N--CA 1.482 1.153 0 CA-C-O 117.813 -1.089 . . . . 0.0 112.603 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.43 -36.43 79.41 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.916 3.077 . . . . 0.0 114.113 169.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.06 -53.29 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 119.275 0.943 . . . . 0.0 111.196 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.16 75.22 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.235 1.014 . . . . 0.0 111.257 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.491 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.9 t90 -69.37 -53.68 18.29 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 117.649 -1.167 . . . . 0.0 112.22 169.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.491 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.6 t90 -65.09 -32.35 74.02 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.03 -1.468 . . . . 0.0 111.998 -167.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 62.8 ttp -53.63 -46.03 70.36 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.544 1.137 . . . . 0.0 111.893 169.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 CA--C 1.546 0.793 0 C-N-CA 125.015 1.326 . . . . 0.0 113.841 -178.08 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.4 mt -57.07 -26.29 60.15 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.3 m -83.54 -32.41 25.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.918 1.287 . . . . 0.0 112.597 173.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -78.71 -34.51 45.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.775 -1.203 . . . . 0.0 113.447 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.49 -38.26 60.04 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 117.379 -1.296 . . . . 0.0 113.474 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -75.6 -37.55 1.7 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 CA-C-N 122.246 1.838 . . . . 0.0 113.18 168.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -64.02 -33.52 75.93 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.593 -1.317 . . . . 0.0 113.766 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.53 -26.4 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.575 0.75 . . . . 0.0 112.789 178.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 52.3 mt -69.42 -50.1 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.632 0.773 . . . . 0.0 109.323 171.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.4 -42.49 91.9 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.055 0.942 . . . . 0.0 111.878 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.57 -25.7 65.03 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.735 -1.228 . . . . 0.0 112.117 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.54 -45.38 25.58 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.288 -0.883 . . . . 0.0 111.829 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -27.29 68.77 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.459 1.481 . . . . 0.0 113.652 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -71.11 -36.04 72.0 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 168.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -127.51 62.62 55.61 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.234 1.414 . . . . 0.0 110.727 -176.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.83 -13.63 27.8 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.521 2.814 . . . . 0.0 114.786 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -81.69 -23.66 36.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.132 1.773 . . . . 0.0 114.304 -178.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -66.26 156.93 32.86 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.84 1.256 . . . . 0.0 112.072 -175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -89.57 131.78 35.41 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.1 tp -48.17 -52.35 21.11 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -168.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.88 -8.03 40.2 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -174.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 72.6 p -57.59 -27.29 62.59 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 120.539 -1.351 . . . . 0.0 111.118 168.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -71.22 -3.86 22.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.469 1.508 . . . . 0.0 114.48 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -34.55 40.6 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.772 1.169 . . . . 0.0 111.655 167.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.75 -31.41 66.63 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.018 1.327 . . . . 0.0 112.392 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -66.06 -30.31 70.81 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.306 1.442 . . . . 0.0 114.456 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -167.803 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 . . . . . 0 N--CA 1.444 -0.735 0 N-CA-C 105.12 -2.178 . . . . 0.0 105.12 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 t -104.73 116.1 31.45 Favored 'General case' 0 CA--C 1.505 -0.756 0 O-C-N 120.585 -1.322 . . . . 0.0 112.313 -166.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.14 -32.82 73.36 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.091 167.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.429 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.4 mtmt -63.24 -28.96 70.39 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.504 1.922 . . . . 0.0 114.209 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -113.59 10.44 18.07 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.236 1.414 . . . . 0.0 112.647 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.458 ' HE2' ' HB2' ' B' ' 98' ' ' LYS . 12.7 ttm -64.29 123.43 19.12 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.726 -1.234 . . . . 0.0 108.616 170.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.8 t -79.36 157.85 27.55 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.117 -0.989 . . . . 0.0 110.695 -174.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.53 -35.6 78.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.587 -1.32 . . . . 0.0 112.84 -174.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -61.24 -33.44 73.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -79.9 -38.48 32.47 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.12 1.368 . . . . 0.0 111.67 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -59.19 -49.65 77.04 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.991 0.917 . . . . 0.0 112.705 176.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -67.71 -5.15 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 C-N-CA 124.362 1.065 . . . . 0.0 112.641 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -107.26 -6.83 17.01 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.325 1.45 . . . . 0.0 113.707 173.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.02 160.82 29.44 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.915 -1.115 . . . . 0.0 110.94 175.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 41.9 t-20 -64.78 131.08 95.05 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 121.157 -0.964 . . . . 0.0 111.999 -176.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 29.7 Cg_exo -60.61 -16.53 43.54 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.437 2.758 . . . . 0.0 114.969 -178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -60.27 -67.39 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.717 1.607 . . . . 0.0 110.161 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.12 -3.74 53.02 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 ttt -57.71 -40.46 79.57 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 169.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -64.83 -54.18 37.35 Favored Pre-proline 0 N--CA 1.481 1.125 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -48.97 -44.41 32.52 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.732 2.955 . . . . 0.0 115.886 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.1 p -72.5 -42.25 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.28 -35.69 70.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.877 0.471 . . . . 0.0 110.229 171.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 75.1 t90 -76.3 -49.84 15.9 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.587 177.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.422 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 1.4 t90 -64.75 -25.33 67.88 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 120.383 1.447 . . . . 0.0 111.264 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -66.92 -50.71 61.52 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.422 1.489 . . . . 0.0 111.693 168.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.856 0 C-N-CA 124.543 1.137 . . . . 0.0 113.765 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.2 t70 . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.0 mt -61.22 -33.61 73.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.892 0.877 . . . . 0.0 112.412 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.2 m -72.9 -35.91 67.19 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.424 1.09 . . . . 0.0 111.404 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm100 -78.52 -24.06 45.94 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.759 -1.115 . . . . 0.0 113.134 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.95 -47.93 95.45 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 120.352 1.433 . . . . 0.0 112.399 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.48 -34.1 21.09 Favored 'Trans proline' 0 C--N 1.354 0.864 0 CA-C-N 121.865 1.702 . . . . 0.0 113.342 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -67.58 -34.33 76.82 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.502 1.501 . . . . 0.0 114.057 -177.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.13 -20.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.77 0.714 . . . . 0.0 112.79 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.83 -50.37 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.501 1.121 . . . . 0.0 110.781 171.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.56 -39.07 79.25 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.9 0.88 . . . . 0.0 111.783 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -69.23 -28.81 66.68 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.434 0.561 . . . . 0.0 111.627 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.7 m -77.68 -46.72 21.1 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.293 -0.88 . . . . 0.0 112.921 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -28.96 67.55 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.85 1.659 . . . . 0.0 114.334 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -75.0 -30.23 61.08 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 173.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -134.13 75.4 65.88 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.098 1.359 . . . . 0.0 112.137 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -59.27 -9.59 8.79 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.405 3.403 . . . . 0.0 117.297 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -81.9 -21.68 37.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.351 1.46 . . . . 0.0 113.129 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -68.76 160.35 30.58 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.809 1.244 . . . . 0.0 111.387 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -83.7 152.04 24.94 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.619 -0.676 . . . . 0.0 110.759 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.9 tp -67.5 -35.4 79.06 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.08 -1.012 . . . . 0.0 113.357 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -90.91 -23.85 20.37 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -58.83 -23.6 60.8 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.366 -0.834 . . . . 0.0 111.675 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -61.46 -4.77 1.41 Allowed 'General case' 0 CA--C 1.539 0.548 0 O-C-N 119.692 -1.88 . . . . 0.0 113.696 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -35.17 67.05 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 120.957 -1.089 . . . . 0.0 111.945 167.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.77 -30.51 71.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.916 0.886 . . . . 0.0 113.249 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.416 ' HG2' ' H ' ' A' ' 72' ' ' GLN . 8.9 pt20 -73.56 -23.14 59.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.729 1.612 . . . . 0.0 114.395 173.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.844 0 C-N-CA 127.0 2.12 . . . . 0.0 116.015 -166.561 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 . . . . . 0 N--CA 1.444 -0.763 0 N-CA-C 103.795 -2.668 . . . . 0.0 103.795 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.2 m -86.44 86.52 7.34 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 125.019 1.328 . . . . 0.0 113.416 -164.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.31 53.53 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.084 1.311 . . . . 0.0 111.033 171.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.409 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 9.4 ptpt -77.67 -0.51 26.96 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.958 2.103 . . . . 0.0 116.411 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -136.45 19.07 3.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.979 1.312 . . . . 0.0 112.233 170.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.4 ttm -60.75 123.22 16.86 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.899 -1.126 . . . . 0.0 108.192 169.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.76 153.87 32.49 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.577 -0.702 . . . . 0.0 109.963 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -61.51 -33.48 73.88 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.805 -1.185 . . . . 0.0 112.991 -173.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -65.94 -30.99 71.66 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.024 0.829 . . . . 0.0 112.975 173.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -77.33 -37.89 51.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.976 1.311 . . . . 0.0 111.101 173.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -62.78 -48.98 76.78 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.446 -0.784 . . . . 0.0 112.702 177.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.6 pt -69.21 -4.11 3.44 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 123.597 0.759 . . . . 0.0 112.977 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.8 -12.62 16.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.145 1.778 . . . . 0.0 114.124 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 159.78 32.87 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 119.763 1.165 . . . . 0.0 110.849 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 51.8 t-20 -66.66 129.09 94.11 Favored Pre-proline 0 N--CA 1.483 1.206 0 O-C-N 121.384 -0.822 . . . . 0.0 111.165 -177.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 97' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 31.2 Cg_exo -59.77 -18.17 47.19 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.927 2.418 . . . . 0.0 114.786 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.458 ' HB2' ' HE2' ' A' ' 8' ' ' MET . 32.1 mttp -56.14 -66.76 0.38 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.184 1.793 . . . . 0.0 109.495 168.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.5 -7.22 59.55 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 17.3 ttm -56.82 -43.27 80.86 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.958 -1.089 . . . . 0.0 111.544 169.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 60.3 m -55.61 -57.48 20.88 Favored Pre-proline 0 N--CA 1.484 1.228 0 CA-C-O 118.036 -0.983 . . . . 0.0 113.551 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -52.93 -43.39 57.06 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.21 3.273 . . . . 0.0 115.621 172.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.2 p -73.92 -39.24 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 120.235 1.38 . . . . 0.0 113.263 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.29 -29.89 69.12 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.086 0.954 . . . . 0.0 111.061 172.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.51 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 61.1 t90 -79.37 -53.49 6.87 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.353 169.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.51 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.5 t90 -64.55 -29.9 70.93 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 120.903 1.683 . . . . 0.0 112.65 -167.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -61.36 -51.28 69.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.355 1.062 . . . . 0.0 111.415 171.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.685 0 C-N-CA 125.671 1.588 . . . . 0.0 111.666 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.7 mt -54.27 -36.75 63.96 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 33.9 m -77.38 -35.03 54.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.166 0.586 . . . . 0.0 111.852 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -79.44 -23.61 43.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 117.57 -1.205 . . . . 0.0 114.071 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mm -53.09 -47.21 96.61 Favored Pre-proline 0 N--CA 1.483 1.182 0 CA-C-N 120.757 1.617 . . . . 0.0 112.406 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.53 -32.0 12.8 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.663 1.575 . . . . 0.0 113.759 172.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.47 -35.68 80.87 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.877 -1.139 . . . . 0.0 113.171 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.8 m -69.33 -26.39 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.476 0.58 . . . . 0.0 112.341 174.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.08 -51.1 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.334 0.654 . . . . 0.0 110.334 172.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -52.49 -47.86 66.29 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.841 0.856 . . . . 0.0 112.075 173.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -69.5 -23.37 63.61 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.175 -0.953 . . . . 0.0 112.311 -175.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -78.43 -48.23 15.87 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.277 -0.89 . . . . 0.0 112.049 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -27.25 69.04 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.929 1.241 . . . . 0.0 113.646 174.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -70.94 -33.54 70.6 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -128.22 63.19 62.0 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.171 1.388 . . . . 0.0 111.029 -176.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.2 -14.77 20.78 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.142 3.228 . . . . 0.0 116.608 -169.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -89.41 -18.23 27.22 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 -178.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -66.45 158.96 28.16 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.573 1.149 . . . . 0.0 112.033 -176.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.02 130.75 34.88 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 62.2 tp -46.14 -37.03 6.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 114.027 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.409 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.5 m-85 -78.76 -9.78 59.55 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.358 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.7 p -64.77 -24.28 67.51 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 120.603 -1.311 . . . . 0.0 111.671 168.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -73.41 -3.72 29.13 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -78.89 -35.03 44.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.922 1.289 . . . . 0.0 111.558 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -68.34 -32.17 72.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.6 1.16 . . . . 0.0 112.39 -169.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -70.12 -29.24 66.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 115.007 173.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.866 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.402 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 28.2 mm-40 . . . . . 0 N--CA 1.471 0.589 0 CA-C-O 117.855 -1.069 . . . . 0.0 112.654 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.5 m 99.24 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 129.645 3.178 . . . . 0.0 115.768 167.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.15 -35.92 72.23 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.997 -1.689 . . . . 0.0 112.339 175.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.463 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -73.13 1.59 8.86 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 173.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -126.22 6.6 7.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.118 1.367 . . . . 0.0 112.126 168.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.45 ' HE2' ' HB2' ' B' ' 98' ' ' LYS . 35.2 ttm -61.61 126.92 29.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.752 -1.217 . . . . 0.0 109.725 172.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.4 t -78.53 154.14 30.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.0 -33.08 74.65 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.8 -1.188 . . . . 0.0 113.132 -174.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -61.88 -32.15 72.49 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -78.62 -38.26 40.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.635 1.174 . . . . 0.0 111.605 175.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -58.13 -50.32 73.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.1 pt -67.5 -7.96 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.48 1.112 . . . . 0.0 113.178 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -105.0 -8.58 18.45 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 125.812 1.645 . . . . 0.0 113.615 175.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.34 159.4 33.4 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 121.065 -1.022 . . . . 0.0 110.738 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -75.93 137.29 69.52 Favored Pre-proline 0 N--CA 1.483 1.199 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -168.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.56 -14.27 41.55 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.159 2.573 . . . . 0.0 116.486 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -63.31 -61.3 2.44 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 125.449 1.5 . . . . 0.0 108.589 166.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.496 ' HB1' HG21 ' B' ' 103' ' ' VAL . . . -81.93 -10.19 59.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.8 ttt -58.63 -35.08 71.92 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.4 m -64.73 -54.56 35.03 Favored Pre-proline 0 N--CA 1.483 1.182 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -176.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.419 ' HG2' HG22 ' B' ' 103' ' ' VAL . 16.4 Cg_endo -54.71 -36.85 91.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.902 2.401 . . . . 0.0 115.739 173.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -38.45 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 119.492 1.042 . . . . 0.0 113.549 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -26.41 67.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.876 0.87 . . . . 0.0 111.151 173.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.517 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 70.7 t90 -87.28 -52.4 5.42 Favored 'General case' 0 C--N 1.343 0.304 0 CA-C-O 117.443 -1.265 . . . . 0.0 112.887 169.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.517 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.5 t90 -67.64 -24.72 65.48 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 121.297 1.862 . . . . 0.0 112.25 -167.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -63.85 -50.16 69.97 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.215 1.006 . . . . 0.0 111.349 169.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.786 0 C-N-CA 125.216 1.406 . . . . 0.0 111.852 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 54.7 mt -66.04 -28.99 69.27 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.551 -0.718 . . . . 0.0 112.025 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.1 m -74.73 -38.53 62.25 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.795 0.838 . . . . 0.0 111.373 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -79.39 -31.16 42.73 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 117.53 -1.224 . . . . 0.0 113.555 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.5 mp -51.23 -42.16 79.47 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 120.79 1.632 . . . . 0.0 113.305 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -71.76 -38.37 4.3 Favored 'Trans proline' 0 C--N 1.352 0.763 0 CA-C-N 122.138 1.799 . . . . 0.0 113.574 169.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mmtt -67.19 -33.41 75.33 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.084 -1.635 . . . . 0.0 113.801 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.3 m -68.2 -18.5 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.1 mt -87.68 -50.44 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.632 1.173 . . . . 0.0 110.268 172.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -58.56 -36.83 74.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.091 0.957 . . . . 0.0 111.934 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -70.85 -28.72 64.8 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.604 0.638 . . . . 0.0 111.882 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -77.11 -41.52 41.73 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.982 -1.073 . . . . 0.0 112.658 176.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -29.2 67.5 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 120.71 1.595 . . . . 0.0 113.973 177.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -81.48 -27.5 34.54 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 173.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -130.8 70.84 82.58 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.625 1.57 . . . . 0.0 110.754 173.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.92 -11.99 13.85 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 124.858 3.705 . . . . 0.0 116.368 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -84.63 -21.45 30.28 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.359 1.464 . . . . 0.0 113.292 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -67.9 156.34 37.41 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.669 0.787 . . . . 0.0 111.996 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -89.06 131.72 35.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.4 -38.42 28.85 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -169.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.26 5.4 m-85 -78.46 -8.3 58.37 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.369 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.7 p -61.01 -23.54 65.48 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.416 -1.427 . . . . 0.0 111.633 167.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.82 -10.72 59.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.699 -1.25 . . . . 0.0 112.568 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -31.78 71.44 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.725 1.148 . . . . 0.0 111.185 168.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.42 -13.44 62.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.642 1.177 . . . . 0.0 112.312 -173.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -82.87 -29.85 29.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.398 2.279 . . . . 0.0 114.689 173.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -164.029 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 . . . . . 0 N--CA 1.473 0.701 0 CA-C-O 118.873 -0.584 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.2 t 94.44 104.52 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.407 3.083 . . . . 0.0 116.231 168.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.64 74.89 Favored 'General case' 0 CA--C 1.551 0.996 0 O-C-N 120.711 -1.243 . . . . 0.0 111.191 169.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.465 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 23.4 mtmt -62.61 -28.03 69.61 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.416 1.486 . . . . 0.0 114.178 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -105.91 8.23 32.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.634 1.173 . . . . 0.0 113.478 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 49.2 ttm -63.91 130.34 43.69 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.644 -1.285 . . . . 0.0 110.392 173.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.2 t -79.32 156.28 28.1 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.01 -1.056 . . . . 0.0 110.814 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.25 -32.67 71.37 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.079 -1.638 . . . . 0.0 112.884 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -63.3 -32.13 73.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -74.96 -40.4 60.78 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.646 0.779 . . . . 0.0 111.938 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -60.34 -46.02 91.41 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.221 0.464 . . . . 0.0 111.892 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -72.21 -10.44 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.614 175.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.45 -20.25 20.48 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 170.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 156.0 37.15 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.029 0.932 . . . . 0.0 112.285 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.436 HD21 ' HD2' ' B' ' 98' ' ' LYS . 1.1 t-20 -56.11 135.45 74.44 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.631 1.172 . . . . 0.0 113.203 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 97' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 13.6 Cg_exo -75.39 -5.87 17.12 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.419 1.413 . . . . 0.0 115.474 -178.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.45 ' HB2' ' HE2' ' A' ' 8' ' ' MET . 12.8 mttt -70.68 -59.74 2.65 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.48 1.491 . . . . 0.0 109.509 167.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 99' ' ' ALA . . . . . 0.437 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -81.55 -11.38 59.18 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -177.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 23.8 ttm -53.98 -31.09 49.66 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.611 -1.306 . . . . 0.0 112.92 171.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 36.3 m -68.44 -57.36 8.73 Favored Pre-proline 0 N--CA 1.484 1.254 0 CA-C-O 117.998 -1.001 . . . . 0.0 112.751 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.03 -36.27 75.43 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.83 3.02 . . . . 0.0 114.096 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.496 HG21 ' HB1' ' A' ' 20' ' ' ALA . 60.7 t -64.12 -52.17 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 121.469 -0.769 . . . . 0.0 111.395 175.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.42 -36.36 80.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.636 1.175 . . . . 0.0 111.372 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.513 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.7 t90 -71.31 -51.12 26.12 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 117.054 -1.45 . . . . 0.0 113.088 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.447 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.91 -27.68 67.69 Favored 'General case' 0 C--N 1.349 0.582 0 C-N-CA 116.911 -1.916 . . . . 0.0 111.139 -169.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.6 tmm? -60.59 -42.1 96.05 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.082 0.953 . . . . 0.0 112.217 169.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.046 1.338 . . . . 0.0 114.395 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.47 -29.96 62.35 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 42.5 m -81.07 -36.39 30.53 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.092 0.957 . . . . 0.0 112.187 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -80.24 -30.06 38.48 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.055 -1.028 . . . . 0.0 113.723 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.84 -41.4 84.53 Favored Pre-proline 0 CA--C 1.552 1.052 0 CA-C-N 120.351 1.432 . . . . 0.0 113.629 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -73.29 -37.32 3.39 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 CA-C-N 122.477 1.92 . . . . 0.0 113.468 169.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -67.65 -28.84 68.05 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 120.338 -1.477 . . . . 0.0 114.232 -175.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.25 -26.72 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 118.59 0.632 . . . . 0.0 112.076 173.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 43.6 mt -70.24 -51.27 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 123.927 0.891 . . . . 0.0 109.438 171.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -53.21 -48.85 67.8 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.79 0.836 . . . . 0.0 112.033 173.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -70.09 -25.1 63.36 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.124 -0.985 . . . . 0.0 112.075 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.34 -46.2 28.65 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.635 0.774 . . . . 0.0 112.177 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -26.69 67.36 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 120.389 1.45 . . . . 0.0 113.622 173.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttm -70.28 -31.58 69.0 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 168.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -133.18 65.25 72.77 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 125.046 1.338 . . . . 0.0 112.381 -179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -58.82 -15.29 25.93 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.094 2.529 . . . . 0.0 116.732 -171.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -83.7 -16.42 45.0 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.922 1.289 . . . . 0.0 113.603 -177.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -72.87 153.8 40.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.953 0.901 . . . . 0.0 111.375 -172.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -85.62 132.82 34.1 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.5 tp -51.52 -36.16 43.68 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 6.1 m-85 -81.76 -6.47 59.08 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.3 p -61.19 -27.55 68.5 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 120.524 -1.36 . . . . 0.0 111.317 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.37 -4.02 23.95 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.472 1.509 . . . . 0.0 114.317 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -29.46 37.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.97 1.308 . . . . 0.0 112.021 167.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.26 -32.31 64.62 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.646 1.178 . . . . 0.0 112.2 -171.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.36 -28.6 67.26 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.697 1.599 . . . . 0.0 114.864 173.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -166.965 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 . . . . . 0 N--CA 1.443 -0.789 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.8 t -102.57 103.44 13.77 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.367 1.467 . . . . 0.0 113.091 -164.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.99 70.52 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.434 -1.416 . . . . 0.0 110.748 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.471 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.0 ptpt -74.1 -4.69 37.14 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -125.83 12.29 7.87 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.151 1.381 . . . . 0.0 112.139 168.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.0 ttm -60.6 122.44 14.72 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.623 -1.298 . . . . 0.0 108.544 170.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.9 t -75.96 154.64 35.72 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.867 -1.146 . . . . 0.0 110.421 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.66 -30.94 71.97 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.267 -1.521 . . . . 0.0 113.342 -172.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -40.72 97.52 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.017 0.826 . . . . 0.0 111.928 170.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.69 -37.36 82.2 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.199 1.0 . . . . 0.0 111.568 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.65 -51.86 67.62 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.563 0.745 . . . . 0.0 112.353 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -69.43 -1.77 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 124.554 1.142 . . . . 0.0 112.737 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -106.59 -7.58 17.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.483 1.513 . . . . 0.0 113.587 171.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.14 160.71 29.48 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.021 -1.049 . . . . 0.0 111.135 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.444 HD21 ' HD3' ' A' ' 19' ' ' LYS . 46.2 t-20 -66.0 128.76 94.04 Favored Pre-proline 0 N--CA 1.484 1.273 0 O-C-N 121.024 -1.047 . . . . 0.0 111.528 -175.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.6 -21.02 23.11 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 124.094 3.196 . . . . 0.0 115.607 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.8 mptt -57.89 -68.07 0.28 Allowed 'General case' 0 C--N 1.351 0.639 0 C-N-CA 126.117 1.767 . . . . 0.0 109.539 168.397 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.423 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -78.17 -7.9 57.64 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 10.9 ttt -62.84 -35.86 81.33 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.291 -1.505 . . . . 0.0 113.206 170.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.4 m -60.43 -53.66 62.53 Favored Pre-proline 0 N--CA 1.485 1.311 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.409 ' HA ' ' CE2' ' B' ' 106' ' ' TRP . 2.7 Cg_endo -49.31 -47.12 23.38 Favored 'Trans proline' 0 CA--C 1.51 -0.694 0 C-N-CA 123.389 2.726 . . . . 0.0 114.133 167.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 20' ' ' ALA . 57.2 t -57.88 -32.94 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.807 0.443 . . . . 0.0 111.793 -178.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.96 -27.42 65.71 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.385 1.074 . . . . 0.0 113.579 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.415 ' CB ' ' CH2' ' B' ' 106' ' ' TRP . 52.4 t90 -88.14 -39.38 14.58 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.81 1.186 . . . . 0.0 109.993 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.537 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 3.6 m95 -62.76 -35.08 78.67 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -167.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -72.85 -47.61 44.65 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.257 1.423 . . . . 0.0 112.787 168.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 124.829 1.251 . . . . 0.0 114.12 -168.81 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 . . . . . 0 N--CA 1.466 0.352 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.49 -25.15 68.13 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.141 -0.975 . . . . 0.0 112.439 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.0 m -78.54 -37.98 41.56 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.592 0.757 . . . . 0.0 111.467 171.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -81.7 -30.85 32.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.974 -1.012 . . . . 0.0 113.148 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.04 -41.68 75.56 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-O 117.232 -1.366 . . . . 0.0 113.008 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.95 -37.85 2.59 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 122.336 1.87 . . . . 0.0 113.807 168.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -67.82 -33.41 74.74 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.032 -1.667 . . . . 0.0 113.633 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 19.1 m -68.32 -13.95 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.4 mt -92.09 -51.09 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.635 1.174 . . . . 0.0 110.578 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.89 -35.52 73.15 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.974 0.909 . . . . 0.0 111.771 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -68.53 -29.62 68.24 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 122.078 -0.389 . . . . 0.0 111.915 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.27 -45.7 31.44 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.838 -1.164 . . . . 0.0 112.745 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.54 68.79 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.644 1.566 . . . . 0.0 113.977 177.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -77.06 -32.82 57.14 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -133.2 77.22 67.4 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 124.639 1.176 . . . . 0.0 112.094 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.55 -9.96 3.13 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 124.772 3.648 . . . . 0.0 117.024 175.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.39 -25.57 51.0 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.045 1.338 . . . . 0.0 112.511 -177.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -67.13 153.59 43.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.926 1.291 . . . . 0.0 111.448 -172.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -87.38 131.61 34.23 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 169.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -51.72 -36.72 47.99 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -169.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.471 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.0 m-85 -79.57 -6.85 57.9 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 58.8 p -59.79 -26.7 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.458 -1.401 . . . . 0.0 111.053 167.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -71.84 -3.1 20.35 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.754 1.622 . . . . 0.0 114.143 177.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -31.65 25.5 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.976 1.31 . . . . 0.0 111.693 169.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.3 -26.19 64.61 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.27 1.028 . . . . 0.0 112.151 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -74.85 -29.51 61.07 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.563 1.545 . . . . 0.0 114.929 171.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 125.04 1.336 . . . . 0.0 114.604 -166.61 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 15.6 t -93.94 97.56 10.44 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -166.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.74 -33.25 64.11 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 120.944 -1.098 . . . . 0.0 111.091 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -64.41 -31.33 72.49 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.537 1.935 . . . . 0.0 114.608 177.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -114.26 13.9 17.98 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.925 1.29 . . . . 0.0 113.132 -177.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.0 ttm -58.77 122.31 13.25 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.919 -1.113 . . . . 0.0 108.888 169.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.6 t -77.46 156.84 30.81 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.876 -1.14 . . . . 0.0 110.682 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.04 -34.06 76.76 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.142 -1.598 . . . . 0.0 112.909 -173.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -65.1 -31.45 72.66 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.192 0.906 . . . . 0.0 112.595 173.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -77.63 -37.08 50.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.784 1.234 . . . . 0.0 111.35 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -62.51 -49.42 75.44 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.331 -0.856 . . . . 0.0 112.28 176.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.05 -7.61 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.683 0.793 . . . . 0.0 112.971 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -100.88 -13.91 18.16 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.936 1.694 . . . . 0.0 113.877 171.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.34 158.42 35.11 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.454 1.025 . . . . 0.0 111.114 173.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -62.33 133.91 94.62 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.894 0.878 . . . . 0.0 112.815 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.43 -13.88 33.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.789 2.326 . . . . 0.0 116.042 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -66.38 -50.41 63.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 121.151 1.796 . . . . 0.0 107.929 168.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -87.98 -5.18 58.66 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 25.0 mtt -55.46 -44.48 76.44 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.652 -1.28 . . . . 0.0 111.98 169.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 89.4 m -61.17 -52.62 70.16 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 124.666 1.186 . . . . 0.0 113.088 -175.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 102' ' ' PRO . . . . . 0.428 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 11.6 Cg_endo -52.97 -49.75 16.48 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 124.047 3.165 . . . . 0.0 114.983 171.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.06 -37.05 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.672 -1.268 . . . . 0.0 112.867 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.38 -29.8 70.74 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.593 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.537 ' CD2' ' CZ2' ' A' ' 27' ' ' TRP . 73.2 t90 -81.81 -46.42 14.2 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.191 1.359 . . . . 0.0 112.452 173.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.415 ' CH2' ' CB ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -41.02 -38.55 1.01 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.703 0.801 . . . . 0.0 111.962 169.485 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 57.5 ttp -75.08 -64.58 1.02 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.409 1.484 . . . . 0.0 113.849 169.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 . . . . . 0 N--CA 1.466 0.36 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.2 mt -54.57 -33.67 60.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.145 0.978 . . . . 0.0 112.881 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 51.9 m -77.51 -35.2 53.74 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.664 0.786 . . . . 0.0 111.92 175.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -81.22 -23.46 38.09 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.94 -47.05 96.87 Favored Pre-proline 0 N--CA 1.482 1.126 0 CA-C-N 120.305 1.411 . . . . 0.0 112.338 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.3 -34.95 14.98 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 122.065 1.773 . . . . 0.0 113.612 172.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -66.0 -32.06 73.33 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.625 -1.297 . . . . 0.0 113.539 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.91 -28.31 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 61.5 mt -69.55 -49.53 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.883 0.873 . . . . 0.0 109.8 172.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.39 -53.52 56.41 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.712 0.805 . . . . 0.0 111.208 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -62.56 -26.41 68.56 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.073 -1.017 . . . . 0.0 113.068 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.75 -48.01 17.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.187 0.903 . . . . 0.0 112.561 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -25.2 67.1 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 121.059 1.754 . . . . 0.0 113.653 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -73.45 -28.02 61.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.725 1.61 . . . . 0.0 114.478 168.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -135.01 63.65 58.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.122 1.369 . . . . 0.0 110.735 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -63.82 -12.42 31.6 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.403 2.735 . . . . 0.0 115.871 -168.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.16 -17.01 38.5 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.348 1.459 . . . . 0.0 113.447 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -74.32 161.38 29.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.536 1.135 . . . . 0.0 111.985 -173.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -75.02 159.99 31.08 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.68 -0.638 . . . . 0.0 109.772 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.9 tp -70.8 -62.91 1.22 Allowed 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.586 -0.696 . . . . 0.0 112.257 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -61.52 -24.0 66.31 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 -167.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.7 t -57.46 -23.68 51.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.742 -0.599 . . . . 0.0 112.066 172.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -63.85 -3.46 2.46 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 119.789 -1.819 . . . . 0.0 114.5 174.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -35.38 63.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.235 1.379 . . . . 0.0 111.396 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -33.56 75.89 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -167.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -67.53 -27.22 66.79 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.541 1.937 . . . . 0.0 115.053 172.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.581 0 C-N-CA 125.102 1.361 . . . . 0.0 113.845 -167.787 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.404 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 23.3 mm-40 . . . . . 0 N--CA 1.469 0.49 0 CA-C-O 118.939 -0.553 . . . . 0.0 111.475 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t 97.78 106.52 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 129.647 3.179 . . . . 0.0 114.682 168.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.49 -31.0 70.97 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.708 -1.245 . . . . 0.0 111.347 170.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.449 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 9.1 mtmt -63.65 -25.08 68.05 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.449 1.5 . . . . 0.0 114.366 175.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.09 5.85 28.33 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.829 1.252 . . . . 0.0 113.356 175.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 41.4 ttm -62.03 125.31 23.43 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.656 -1.277 . . . . 0.0 109.922 173.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -78.57 155.92 29.42 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.842 -1.161 . . . . 0.0 110.187 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.63 -35.71 78.66 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.588 -1.32 . . . . 0.0 112.84 -174.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -61.69 -35.03 76.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 172.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -77.09 -37.38 54.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.653 1.181 . . . . 0.0 111.342 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -60.49 -49.91 75.65 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.619 -0.675 . . . . 0.0 112.378 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.5 pt -69.49 -1.68 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 124.394 1.078 . . . . 0.0 112.663 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -110.0 -12.27 14.55 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.522 1.529 . . . . 0.0 113.897 174.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.25 163.08 25.81 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 121.02 -1.05 . . . . 0.0 110.5 169.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.481 HD21 ' HD3' ' A' ' 19' ' ' LYS . 47.4 t-20 -66.1 131.18 94.42 Favored Pre-proline 0 N--CA 1.483 1.192 0 O-C-N 120.745 -1.222 . . . . 0.0 112.05 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 30.6 Cg_exo -61.39 -16.3 46.37 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.459 2.772 . . . . 0.0 115.415 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HD3' HD21 ' A' ' 17' ' ' ASN . 5.1 mptt -56.93 -61.74 2.23 Favored 'General case' 0 C--N 1.35 0.61 0 C-N-CA 125.983 1.713 . . . . 0.0 108.814 168.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.452 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -82.44 -7.74 59.63 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 86.5 mtp -58.86 -37.0 75.52 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 120.403 1.456 . . . . 0.0 112.859 171.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.9 m -62.04 -55.96 36.06 Favored Pre-proline 0 N--CA 1.486 1.344 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -56.21 -39.05 93.72 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.265 2.643 . . . . 0.0 112.885 169.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 20' ' ' ALA . 99.1 t -60.39 -42.84 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 120.033 -1.667 . . . . 0.0 111.969 175.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.34 -41.98 79.97 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.082 0.953 . . . . 0.0 110.962 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HB3' ' CH2' ' B' ' 106' ' ' TRP 0.267 0.0 OUTLIER -73.34 -41.58 63.3 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 115.974 -1.965 . . . . 0.0 111.404 177.029 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.484 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 0.3 OUTLIER -65.58 -25.22 67.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.644 2.474 . . . . 0.0 113.85 175.851 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -67.04 -45.52 77.17 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.808 -0.557 . . . . 0.0 111.144 168.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 113.734 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 68.3 mt -64.57 -19.24 65.53 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.143 0.977 . . . . 0.0 112.954 175.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.5 m -89.15 -27.63 20.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.529 1.932 . . . . 0.0 112.323 173.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -83.45 -33.98 25.54 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 120.814 -1.178 . . . . 0.0 111.823 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.52 -42.76 89.76 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-O 117.227 -1.368 . . . . 0.0 113.535 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.13 -39.77 7.25 Favored 'Trans proline' 0 C--N 1.35 0.654 0 CA-C-N 122.571 1.954 . . . . 0.0 112.845 169.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -62.94 -38.81 92.53 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.625 1.557 . . . . 0.0 113.461 -176.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.0 m -70.41 -19.54 22.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.372 0.669 . . . . 0.0 112.491 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.8 mt -81.36 -47.99 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.316 -0.865 . . . . 0.0 109.933 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.84 -37.22 78.64 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.101 0.96 . . . . 0.0 112.008 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -68.62 -26.23 65.25 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.695 0.679 . . . . 0.0 111.758 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.0 m -77.65 -46.74 21.11 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.234 -0.916 . . . . 0.0 112.89 174.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -29.17 67.95 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 120.799 1.636 . . . . 0.0 114.166 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.66 -27.76 55.72 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -135.16 74.31 62.59 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.996 1.318 . . . . 0.0 112.073 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -59.03 -9.66 8.39 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 124.36 3.373 . . . . 0.0 117.371 -177.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -82.21 -22.11 36.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.981 1.312 . . . . 0.0 113.139 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? -68.9 157.7 36.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.3 1.04 . . . . 0.0 111.7 -174.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -75.86 152.39 37.21 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 169.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.5 -39.92 81.1 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.015 -1.053 . . . . 0.0 113.087 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.449 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.2 m-85 -86.68 -19.28 29.46 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -58.97 -23.46 61.7 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.318 -0.864 . . . . 0.0 111.671 170.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -58.19 -15.81 11.27 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.761 -1.837 . . . . 0.0 112.902 171.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.3 tptt -58.58 -35.28 72.15 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.045 -1.034 . . . . 0.0 112.597 168.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.16 -26.03 67.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.714 0.806 . . . . 0.0 112.208 -169.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -68.48 -30.21 69.0 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.894 2.078 . . . . 0.0 114.233 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.784 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -165.194 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.2 t -97.84 98.36 9.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 120.948 -1.095 . . . . 0.0 113.89 -166.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.52 62.79 Favored 'General case' 0 CA--C 1.555 1.164 0 O-C-N 120.771 -1.205 . . . . 0.0 110.815 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt -59.7 -30.78 69.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.988 2.115 . . . . 0.0 115.03 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -117.52 12.69 14.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.837 1.255 . . . . 0.0 113.107 -175.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 54.4 ttm -60.88 119.7 8.74 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.002 -1.061 . . . . 0.0 108.949 169.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -75.95 156.42 34.19 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.115 -0.99 . . . . 0.0 110.422 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -33.19 73.86 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.486 -1.384 . . . . 0.0 112.957 -172.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -65.75 -32.87 74.66 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.153 0.888 . . . . 0.0 112.865 173.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -77.41 -35.6 54.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.274 1.43 . . . . 0.0 111.17 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.51 -51.36 65.83 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.307 1.043 . . . . 0.0 112.411 175.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.9 pt -68.01 -4.03 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -103.01 -11.25 18.3 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.088 1.755 . . . . 0.0 114.182 170.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.17 157.61 37.31 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.983 1.265 . . . . 0.0 110.748 171.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.413 HD21 ' HD3' ' B' ' 98' ' ' LYS 0.262 0.1 OUTLIER -73.37 146.51 86.61 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -169.66 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -71.84 -10.55 26.51 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.865 1.71 . . . . 0.0 114.717 -177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.413 ' HD3' HD21 ' B' ' 96' ' ' ASN . 5.8 mptt -67.81 -55.44 12.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.876 1.216 . . . . 0.0 108.572 167.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.65 -13.96 52.98 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.9 mmt -47.69 -43.43 26.55 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.742 1.156 . . . . 0.0 112.581 171.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -61.3 -55.31 44.77 Favored Pre-proline 0 N--CA 1.481 1.111 0 C-N-CA 124.535 1.134 . . . . 0.0 113.606 -171.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 102' ' ' PRO . . . . . 0.402 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 14.0 Cg_endo -54.7 -47.4 26.92 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.471 2.781 . . . . 0.0 114.513 171.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.7 p -70.17 -34.54 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 120.574 -1.329 . . . . 0.0 113.095 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.61 -25.21 67.28 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.671 0.788 . . . . 0.0 111.746 173.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.484 ' CG ' ' CZ2' ' A' ' 27' ' ' TRP . 62.6 t90 -80.78 -50.27 10.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.436 1.017 . . . . 0.0 111.254 168.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CH2' ' HB3' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -50.45 -44.37 55.47 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 121.696 0.76 . . . . 0.0 112.258 -172.724 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -64.47 -45.36 87.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.317 1.047 . . . . 0.0 112.045 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 C-N-CA 125.072 1.349 . . . . 0.0 113.012 -171.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -32.64 67.51 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 59.3 m -78.57 -36.04 45.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.701 0.8 . . . . 0.0 111.796 175.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -81.42 -32.96 32.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 117.428 -1.273 . . . . 0.0 114.421 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -48.11 -47.92 64.75 Favored Pre-proline 0 N--CA 1.482 1.157 0 CA-C-N 120.667 1.576 . . . . 0.0 113.175 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.92 -32.26 29.29 Favored 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 122.116 1.791 . . . . 0.0 113.811 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -65.2 -30.78 71.71 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.584 -1.322 . . . . 0.0 113.456 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.55 -31.76 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.285 0.493 . . . . 0.0 111.267 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -71.84 -50.77 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.564 1.146 . . . . 0.0 109.847 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.85 -39.96 82.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.414 0.686 . . . . 0.0 112.453 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -71.43 -27.44 63.29 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 118.828 0.74 . . . . 0.0 112.725 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -73.84 -47.99 34.44 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.403 -0.811 . . . . 0.0 112.478 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -26.79 67.82 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 120.359 1.436 . . . . 0.0 114.832 -178.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -80.67 -16.93 52.75 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -137.78 65.34 45.91 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 125.425 1.49 . . . . 0.0 111.463 174.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -64.12 -11.59 28.33 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.856 3.037 . . . . 0.0 115.923 -169.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -83.99 -17.1 41.62 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.014 1.325 . . . . 0.0 113.328 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -74.01 158.95 33.39 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.615 1.166 . . . . 0.0 111.545 -174.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.63 154.05 27.61 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.674 -0.641 . . . . 0.0 110.094 172.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -66.3 -44.9 82.18 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.24 -0.913 . . . . 0.0 113.044 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -77.55 -19.77 55.19 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -169.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 12.6 t -64.45 -16.4 62.36 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.738 -1.226 . . . . 0.0 112.412 169.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -67.56 -2.97 7.47 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.348 -2.095 . . . . 0.0 113.499 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -27.95 35.71 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.28 1.432 . . . . 0.0 112.293 167.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -64.36 -35.44 80.89 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.899 1.28 . . . . 0.0 112.049 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -72.1 -28.35 63.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.445 1.898 . . . . 0.0 115.403 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.79 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -166.673 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.443 -0.805 0 N-CA-C 103.614 -2.735 . . . . 0.0 103.614 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 m -94.9 87.72 5.06 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 125.331 1.452 . . . . 0.0 112.458 -163.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.29 -34.55 70.66 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 121.026 1.739 . . . . 0.0 110.706 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -20.52 62.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.72 2.408 . . . . 0.0 113.969 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -125.16 18.35 8.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.338 1.455 . . . . 0.0 112.145 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.7 ttm -60.62 119.67 8.55 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 169.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.68 154.8 36.29 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.069 -1.02 . . . . 0.0 109.458 -178.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.4 -34.62 75.66 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.466 -1.396 . . . . 0.0 112.951 -173.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -63.06 -34.62 77.98 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 172.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -76.14 -37.84 57.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.225 1.41 . . . . 0.0 111.253 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -62.14 -48.69 78.98 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.207 -0.933 . . . . 0.0 112.343 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.0 pt -70.35 -2.22 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 C-N-CA 123.671 0.788 . . . . 0.0 112.672 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -107.62 -15.33 14.61 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.86 1.664 . . . . 0.0 113.684 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.24 159.13 24.42 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.02 -1.05 . . . . 0.0 110.261 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.606 HD21 ' HD3' ' A' ' 19' ' ' LYS . 47.9 t-20 -67.01 128.09 93.75 Favored Pre-proline 0 N--CA 1.478 0.961 0 O-C-N 121.269 -0.894 . . . . 0.0 109.346 177.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -65.68 -20.72 59.47 Favored 'Trans proline' 0 N--CA 1.444 -1.397 0 C-N-CA 122.48 2.12 . . . . 0.0 111.636 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.8 mptt -48.79 -52.44 23.93 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 120.273 1.397 . . . . 0.0 108.697 169.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.66 0.04 40.45 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 31.6 mtt -65.89 -49.71 67.09 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 120.121 1.328 . . . . 0.0 112.199 173.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.25 -54.69 11.22 Favored Pre-proline 0 N--CA 1.49 1.564 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -176.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -60.05 -42.38 44.46 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.324 2.016 . . . . 0.0 113.725 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.402 HG22 ' HG2' ' B' ' 102' ' ' PRO . 12.0 t -63.2 -45.82 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.336 0.971 . . . . 0.0 111.023 177.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.61 91.13 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.71 1.204 . . . . 0.0 111.109 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 73.8 t90 -68.87 -52.99 23.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 117.794 -1.098 . . . . 0.0 112.651 170.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.425 ' CH2' ' HB3' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -51.57 -41.73 61.37 Favored 'General case' 0 C--N 1.347 0.486 0 CA-C-O 122.428 1.109 . . . . 0.0 111.491 -174.976 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -66.18 -44.29 84.42 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.488 1.515 . . . . 0.0 112.143 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.468 0.459 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.5 p30 . . . . . 0 N--CA 1.469 0.475 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.97 -27.69 68.34 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.773 1.169 . . . . 0.0 111.963 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.0 m -74.55 -36.99 63.12 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.701 0.4 . . . . 0.0 110.33 169.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -84.09 -27.24 28.38 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -174.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.94 -41.02 77.1 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 121.212 1.824 . . . . 0.0 112.489 176.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.48 -38.0 2.82 Favored 'Trans proline' 0 C--N 1.353 0.777 0 CA-C-N 122.301 1.858 . . . . 0.0 113.432 168.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -66.95 -30.68 70.88 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.509 -1.37 . . . . 0.0 113.802 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.9 m -70.47 -20.98 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.097 0.862 . . . . 0.0 112.556 173.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 mt -81.78 -50.73 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 O-C-N 121.48 -0.763 . . . . 0.0 110.242 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.38 -41.81 85.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.835 0.854 . . . . 0.0 111.747 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -70.89 -22.75 62.24 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.994 -1.066 . . . . 0.0 111.725 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.5 m -79.44 -45.25 19.8 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.498 172.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -27.49 68.89 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.825 1.648 . . . . 0.0 113.761 173.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -69.15 -38.15 78.63 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 168.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -128.74 68.44 78.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.791 1.236 . . . . 0.0 112.143 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -55.59 -15.8 13.09 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.471 2.781 . . . . 0.0 115.883 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -80.14 -25.05 40.03 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.918 1.687 . . . . 0.0 113.268 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -75.55 162.89 27.9 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.07 1.348 . . . . 0.0 112.186 -170.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -77.34 150.6 35.17 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.584 -0.697 . . . . 0.0 109.175 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.7 tp -67.28 -33.85 76.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -88.78 -22.59 23.2 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -169.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.7 t -59.74 -21.09 60.23 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.508 -0.745 . . . . 0.0 111.842 169.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -58.57 -14.62 8.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 119.529 -1.982 . . . . 0.0 113.747 171.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -34.33 72.7 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.101 1.319 . . . . 0.0 111.845 166.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -25.51 66.57 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.663 0.744 . . . . 0.0 112.447 -170.217 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -66.65 -33.85 76.57 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.602 1.961 . . . . 0.0 113.938 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -165.458 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.272 9.6 mt-10 . . . . . 0 CA--C 1.558 1.276 0 CA-C-O 121.913 0.863 . . . . 0.0 109.041 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' SER . . . . . 0.58 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 37.1 t -129.33 113.18 14.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.982 1.713 . . . . 0.0 113.804 -169.397 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 84' ' ' ALA . . . . . 0.444 ' HB2' ' O ' ' A' ' 19' ' ' LYS . . . -61.34 -32.59 72.48 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 119.702 -1.874 . . . . 0.0 111.354 169.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -62.18 -24.16 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.814 2.045 . . . . 0.0 114.048 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -115.64 11.43 15.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.368 1.467 . . . . 0.0 113.369 176.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 51.3 ttm -62.88 125.44 23.97 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.644 -1.285 . . . . 0.0 109.939 171.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 155.66 31.14 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.04 -1.038 . . . . 0.0 110.487 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.8 -32.01 73.5 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.163 -1.585 . . . . 0.0 113.186 -172.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.44 -30.94 71.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.804 0.729 . . . . 0.0 112.663 171.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -81.53 -33.88 31.52 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.859 1.664 . . . . 0.0 111.32 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -64.12 -48.51 75.8 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.854 0.861 . . . . 0.0 112.987 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.1 pt -68.9 -4.12 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 176.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.98 -11.48 16.64 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.222 1.809 . . . . 0.0 114.081 172.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 158.41 36.2 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.928 1.24 . . . . 0.0 110.856 175.225 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 44.1 t-20 -64.45 132.88 95.5 Favored Pre-proline 0 CA--C 1.551 1.003 0 O-C-N 121.246 -0.909 . . . . 0.0 111.871 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 97' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 25.4 Cg_exo -63.81 -15.03 46.58 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.921 2.414 . . . . 0.0 114.5 -178.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -55.51 -67.22 0.3 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.325 1.45 . . . . 0.0 108.868 167.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 99' ' ' ALA . . . . . 0.434 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -74.91 -14.35 60.64 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 33.3 ttm -56.48 -34.56 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.882 -1.136 . . . . 0.0 113.081 175.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 41.5 m -63.16 -58.15 17.45 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 102' ' ' PRO . . . . . 0.402 ' HG2' HG22 ' A' ' 24' ' ' VAL . 18.5 Cg_endo -55.42 -39.11 92.83 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 123.486 2.791 . . . . 0.0 112.469 169.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.434 HG23 ' O ' ' B' ' 99' ' ' ALA . 68.9 t -60.74 -43.69 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 120.059 -1.651 . . . . 0.0 111.478 176.591 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.18 -40.01 86.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.461 -0.78 . . . . 0.0 111.554 -175.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.425 ' HB3' ' CH2' ' A' ' 27' ' ' TRP 0.276 0.0 OUTLIER -74.61 -42.52 58.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 116.674 -1.631 . . . . 0.0 111.021 175.042 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.497 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -65.84 -22.5 66.55 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 122.353 2.342 . . . . 0.0 114.15 176.907 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 3.9 ttp -76.3 -49.45 16.93 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.387 1.075 . . . . 0.0 111.263 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 CA--C 1.544 0.73 0 C-N-CA 123.649 0.779 . . . . 0.0 112.293 -175.441 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 . . . . . 0 N--CA 1.466 0.342 0 CA-C-O 119.08 -0.486 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 97.6 mt -57.17 -30.58 64.61 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.272 0.942 . . . . 0.0 112.584 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 43.7 m -79.21 -36.73 39.67 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.695 0.798 . . . . 0.0 111.77 173.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -83.46 -29.74 27.78 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.67 -44.79 91.06 Favored Pre-proline 0 CA--C 1.553 1.069 0 CA-C-N 120.53 1.514 . . . . 0.0 112.526 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.95 -34.79 10.12 Favored 'Trans proline' 0 C--N 1.352 0.755 0 CA-C-N 122.363 1.88 . . . . 0.0 113.561 171.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -65.6 -33.6 76.27 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.392 -1.442 . . . . 0.0 113.562 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.03 -28.59 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.562 0.619 . . . . 0.0 111.792 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.7 mt -71.31 -48.22 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.5 171.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -54.92 -44.89 74.63 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.15 0.98 . . . . 0.0 111.66 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.57 -32.58 74.25 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.436 -0.79 . . . . 0.0 112.383 -178.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.77 -47.1 61.35 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.443 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.79 -29.98 67.42 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.568 1.531 . . . . 0.0 114.512 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 24.6 pttt -78.69 -23.59 45.51 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -134.64 73.22 68.05 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 125.017 1.327 . . . . 0.0 111.91 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -61.04 -12.71 23.93 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.705 2.937 . . . . 0.0 117.208 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -80.3 -21.52 42.52 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.587 1.155 . . . . 0.0 113.22 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -63.56 152.73 37.87 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.766 0.827 . . . . 0.0 111.795 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -85.97 132.17 34.13 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 66.8 tp -49.8 -43.51 48.58 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -168.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -75.93 -7.9 55.67 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.852 -1.155 . . . . 0.0 113.982 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 58.8 p -57.54 -25.98 60.72 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.343 -1.473 . . . . 0.0 111.38 168.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -70.76 -1.99 13.27 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.794 1.237 . . . . 0.0 113.914 177.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -32.44 50.87 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.65 1.18 . . . . 0.0 111.611 166.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -66.31 -28.5 68.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.506 1.122 . . . . 0.0 112.887 -168.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -73.56 -30.07 62.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.693 1.997 . . . . 0.0 115.757 169.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 124.491 1.116 . . . . 0.0 113.856 -167.121 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.446 -0.67 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.1 t -105.06 108.89 20.65 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 120.765 -1.209 . . . . 0.0 112.66 -166.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' B' ' 98' ' ' LYS . . . -63.27 -29.8 71.06 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.796 -1.19 . . . . 0.0 111.209 170.444 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 14.5 mtmt -60.25 -44.62 95.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.527 1.131 . . . . 0.0 112.281 175.094 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -99.33 15.02 27.59 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.807 1.243 . . . . 0.0 113.982 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 57.2 ttm -60.78 126.14 26.3 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -78.57 154.75 30.1 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.288 -1.508 . . . . 0.0 110.491 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.51 -34.0 74.76 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.314 -1.491 . . . . 0.0 112.968 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -62.1 -31.61 72.09 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.791 0.836 . . . . 0.0 113.251 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -80.49 -36.03 33.93 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.402 1.481 . . . . 0.0 111.348 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -59.86 -48.85 80.01 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.354 -0.841 . . . . 0.0 111.981 175.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.0 pt -71.51 -2.11 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 125.056 1.342 . . . . 0.0 113.246 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.64 -13.02 16.11 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.343 1.457 . . . . 0.0 113.155 170.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.82 158.6 35.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.313 1.045 . . . . 0.0 111.31 175.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 7.1 t-20 -64.65 139.7 97.83 Favored Pre-proline 0 N--CA 1.48 1.026 0 C-N-CA 123.719 0.808 . . . . 0.0 112.443 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' ASN 0.284 12.1 Cg_exo -78.39 -9.7 16.21 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 CA-C-N 120.809 1.325 . . . . 0.0 114.31 -174.539 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.602 ' HB2' ' HE2' ' B' ' 87' ' ' MET . 28.6 mttp -66.54 -54.22 26.11 Favored 'General case' 0 C--N 1.356 0.867 0 CA-C-N 120.338 1.426 . . . . 0.0 107.521 166.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.505 ' HB1' HG21 ' B' ' 103' ' ' VAL . . . -79.16 -5.92 55.32 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.5 mtt -58.64 -51.84 68.23 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.351 0.978 . . . . 0.0 111.821 170.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.3 m -54.53 -49.82 88.85 Favored Pre-proline 0 N--CA 1.482 1.159 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -173.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.501 ' HG2' HG22 ' B' ' 103' ' ' VAL . 9.8 Cg_endo -53.5 -45.95 37.29 Favored 'Trans proline' 0 N--CA 1.476 0.489 0 C-N-CA 123.227 2.618 . . . . 0.0 116.47 170.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.31 -41.28 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 120.841 -1.162 . . . . 0.0 112.469 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.26 -27.96 67.68 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.371 1.068 . . . . 0.0 111.125 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 57.6 t90 -82.0 -51.13 8.35 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-O 117.189 -1.386 . . . . 0.0 113.103 170.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.9 t90 -62.96 -31.43 72.53 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 120.652 1.569 . . . . 0.0 110.797 -168.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 62.4 ttp -57.68 -51.88 67.73 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.041 1.336 . . . . 0.0 112.12 167.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 C-N-CA 125.374 1.47 . . . . 0.0 113.887 -175.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 . . . . . 0 N--CA 1.466 0.343 0 CA-C-O 119.696 -0.192 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 81.6 mt -63.56 -26.05 68.52 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.058 -1.026 . . . . 0.0 112.501 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.3 m -75.27 -38.75 60.32 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.015 0.526 . . . . 0.0 110.958 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -86.91 -27.91 23.09 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.041 -0.981 . . . . 0.0 113.628 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.6 mp -51.78 -43.63 88.83 Favored Pre-proline 0 CA--C 1.551 0.998 0 CA-C-N 120.641 1.564 . . . . 0.0 113.005 175.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.21 -39.56 7.4 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 122.054 1.769 . . . . 0.0 113.555 169.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.64 -37.52 87.65 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.431 1.014 . . . . 0.0 112.909 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.49 -26.23 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 177.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.6 mt -73.74 -52.47 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 121.776 -0.578 . . . . 0.0 110.195 173.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -55.45 -49.27 72.89 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.611 0.765 . . . . 0.0 110.502 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -65.45 -25.51 67.55 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.514 -0.741 . . . . 0.0 112.019 -176.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.67 -47.98 15.91 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.125 0.875 . . . . 0.0 112.295 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -26.68 68.4 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.662 1.574 . . . . 0.0 113.748 174.202 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 mtpp -72.75 -29.03 62.99 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.778 1.631 . . . . 0.0 114.492 169.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -135.04 66.79 68.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.138 1.375 . . . . 0.0 112.397 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -57.65 -13.55 14.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 123.514 2.809 . . . . 0.0 116.914 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -83.97 -21.06 31.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.226 1.41 . . . . 0.0 113.762 -178.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -69.06 156.0 39.39 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.928 0.891 . . . . 0.0 111.775 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -92.84 122.75 35.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.7 tp -42.69 -52.9 4.74 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -165.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.411 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.4 m-85 -68.32 -8.11 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -173.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -55.69 -28.16 54.12 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 121.021 -1.049 . . . . 0.0 111.294 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -71.99 -1.22 13.77 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.642 1.577 . . . . 0.0 114.336 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -31.61 25.89 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.183 1.356 . . . . 0.0 110.936 166.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.53 -26.65 64.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.937 0.895 . . . . 0.0 111.909 -170.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -72.97 -28.99 62.73 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.553 1.541 . . . . 0.0 114.937 171.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.647 0 C-N-CA 125.165 1.386 . . . . 0.0 113.78 -167.854 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.501 ' HB3' ' HG2' ' A' ' 19' ' ' LYS . 3.2 mm-40 . . . . . 0 CA--C 1.548 0.873 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.1 t -105.38 103.51 13.05 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 120.264 -1.523 . . . . 0.0 113.746 -164.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.21 -35.68 67.59 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.758 -1.214 . . . . 0.0 110.275 170.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -66.53 -20.61 66.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.398 2.279 . . . . 0.0 115.512 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -123.65 9.4 8.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.628 1.171 . . . . 0.0 113.213 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' MET . . . . . 0.602 ' HE2' ' HB2' ' A' ' 19' ' ' LYS . 27.9 ttm -61.4 134.04 56.47 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 120.552 -1.342 . . . . 0.0 109.858 169.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 9.3 p -71.81 169.85 14.88 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 121.948 0.88 . . . . 0.0 112.381 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.2 m -70.37 -38.68 74.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.933 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -63.78 -37.73 88.45 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.416 1.007 . . . . 0.0 112.37 173.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -73.12 -39.03 66.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.483 1.113 . . . . 0.0 111.598 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -61.5 -49.46 76.66 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.431 -0.793 . . . . 0.0 113.105 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.3 pt -68.41 -4.72 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 176.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -105.9 -10.75 16.48 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.282 1.833 . . . . 0.0 114.058 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 158.84 34.72 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.767 1.167 . . . . 0.0 110.887 176.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -58.11 134.21 84.18 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.186 0.995 . . . . 0.0 113.164 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.95 -16.86 32.49 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 122.693 2.262 . . . . 0.0 115.686 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 5' ' ' ALA . 9.0 mptt -63.7 -49.23 73.93 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 121.003 1.729 . . . . 0.0 109.716 170.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 99' ' ' ALA . . . . . 0.487 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -86.38 -16.03 38.58 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.4 ttm -54.6 -34.86 62.68 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.462 -1.399 . . . . 0.0 113.236 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 56.3 m -65.58 -57.38 14.61 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-O 117.535 -1.222 . . . . 0.0 112.911 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -52.79 -38.72 78.25 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.881 3.054 . . . . 0.0 114.444 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.505 HG21 ' HB1' ' A' ' 20' ' ' ALA . 58.4 t -62.83 -52.61 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 121.9 -0.5 . . . . 0.0 111.286 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.94 -40.99 95.37 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.291 1.037 . . . . 0.0 110.842 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 82.5 t90 -68.19 -50.04 56.89 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.577 -1.201 . . . . 0.0 112.626 175.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.414 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.2 t90 -67.77 -29.91 69.23 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 120.746 1.612 . . . . 0.0 111.56 -168.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.8 tmm? -60.41 -48.5 81.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.578 1.151 . . . . 0.0 111.577 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.545 0.78 0 C-N-CA 124.89 1.276 . . . . 0.0 113.18 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 119.802 -0.142 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -56.01 -32.61 64.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.748 0.819 . . . . 0.0 112.265 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 26.1 m -80.86 -38.53 27.98 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.648 0.779 . . . . 0.0 112.287 173.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -78.0 -31.83 50.84 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 117.321 -1.324 . . . . 0.0 114.452 -175.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.51 -46.37 90.55 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 121.2 1.818 . . . . 0.0 112.998 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.25 -38.54 8.77 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 121.941 1.729 . . . . 0.0 113.428 172.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -67.54 -31.73 72.02 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.746 -1.221 . . . . 0.0 113.773 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.3 -26.86 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 118.384 0.538 . . . . 0.0 111.994 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 39.7 mt -71.0 -50.18 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.701 0.8 . . . . 0.0 109.715 171.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.93 -45.48 82.7 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.759 0.824 . . . . 0.0 111.813 175.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.88 -24.87 65.28 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.653 -1.279 . . . . 0.0 112.299 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.9 -46.94 19.89 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.916 0.78 . . . . 0.0 112.207 176.323 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -26.19 68.04 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 120.363 1.438 . . . . 0.0 113.981 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -68.92 -31.1 69.77 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 168.09 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -133.05 63.83 68.27 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 124.872 1.269 . . . . 0.0 112.322 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -56.9 -20.03 34.43 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.166 2.578 . . . . 0.0 116.435 -171.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -80.2 -16.77 54.07 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.605 1.162 . . . . 0.0 113.283 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -74.25 165.89 24.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.612 1.165 . . . . 0.0 112.219 -172.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -80.46 151.57 29.21 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 49.2 tp -68.56 -38.97 81.21 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.2 -20.16 30.59 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -169.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.8 t -62.06 -16.47 52.23 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.048 -1.033 . . . . 0.0 112.127 171.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.5 -4.04 5.31 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 119.512 -1.992 . . . . 0.0 114.336 168.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.13 -28.35 35.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.293 1.437 . . . . 0.0 111.988 166.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -65.17 -35.47 81.19 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.175 1.39 . . . . 0.0 112.075 -174.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -70.78 -28.22 64.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.348 1.859 . . . . 0.0 114.948 173.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -167.598 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 118.55 -0.738 . . . . 0.0 112.681 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 93.75 104.4 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.982 2.913 . . . . 0.0 117.45 167.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.49 -29.06 68.83 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 119.855 -1.778 . . . . 0.0 112.306 169.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 7.7 mtmt -65.28 -30.85 71.75 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.145 1.378 . . . . 0.0 114.118 174.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -100.8 4.95 43.32 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.479 1.111 . . . . 0.0 113.077 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.9 ttm -63.89 139.83 58.81 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 119.604 1.093 . . . . 0.0 110.487 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.3 p -78.44 175.88 9.89 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.038 -1.038 . . . . 0.0 112.247 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.31 -39.72 53.36 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.702 171.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.78 -35.96 79.69 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.11 0.868 . . . . 0.0 112.23 171.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -75.72 -38.55 58.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.66 1.184 . . . . 0.0 111.948 176.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -57.5 -50.58 72.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 121.478 -0.764 . . . . 0.0 112.792 176.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.9 pt -68.26 -4.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 C-N-CA 124.094 0.958 . . . . 0.0 112.519 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -106.98 -13.61 15.16 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.337 1.455 . . . . 0.0 114.291 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.73 163.77 27.18 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 120.892 -1.13 . . . . 0.0 111.048 173.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.49 HD21 ' HD3' ' A' ' 19' ' ' LYS . 44.0 t-20 -65.07 131.52 95.19 Favored Pre-proline 0 N--CA 1.484 1.23 0 O-C-N 120.683 -1.261 . . . . 0.0 112.531 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.94 -16.16 37.08 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.82 3.014 . . . . 0.0 115.669 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.49 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.9 mptt -58.17 -65.49 0.64 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 125.776 1.631 . . . . 0.0 108.899 167.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.456 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -78.02 -9.61 59.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -177.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 83.7 mtp -58.1 -35.97 72.2 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.797 1.181 . . . . 0.0 112.749 171.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.5 m -64.19 -55.95 27.56 Favored Pre-proline 0 N--CA 1.484 1.236 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.23 -35.31 95.39 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.325 2.683 . . . . 0.0 114.224 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 20' ' ' ALA . 95.1 t -63.1 -52.36 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.392 0.677 . . . . 0.0 111.617 173.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.97 -39.32 91.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.045 1.338 . . . . 0.0 110.708 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 72.4 t90 -67.74 -51.86 44.3 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-O 116.944 -1.503 . . . . 0.0 112.644 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.455 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.4 t90 -67.28 -25.05 65.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.973 1.715 . . . . 0.0 111.7 -169.392 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -67.66 -46.19 73.1 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.448 1.099 . . . . 0.0 111.702 169.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.57 -26.89 68.82 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.316 -0.865 . . . . 0.0 111.794 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.4 m -77.91 -36.21 49.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.221 1.008 . . . . 0.0 111.502 171.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.99 -28.97 29.33 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.31 -39.69 73.61 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-O 117.176 -1.392 . . . . 0.0 112.78 177.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.597 ' HA ' HD12 ' A' ' 55' ' ' ILE . 44.8 Cg_endo -73.98 -37.94 2.51 Favored 'Trans proline' 0 C--N 1.354 0.825 0 CA-C-N 122.307 1.859 . . . . 0.0 113.317 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -66.46 -32.41 73.75 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.486 -1.383 . . . . 0.0 113.683 -176.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.62 -17.31 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.597 HD12 ' HA ' ' A' ' 52' ' ' PRO . 11.3 mt -83.45 -52.82 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.416 1.087 . . . . 0.0 109.633 172.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -56.41 -49.9 73.19 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.027 0.931 . . . . 0.0 110.735 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -62.34 -24.77 67.53 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.438 -0.789 . . . . 0.0 111.596 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.73 -47.39 14.03 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.397 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -27.87 69.58 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.848 1.658 . . . . 0.0 113.696 172.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -73.02 -30.52 63.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.787 1.635 . . . . 0.0 115.115 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -131.59 66.62 78.64 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.227 1.411 . . . . 0.0 110.479 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -60.57 -14.36 30.5 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.592 2.861 . . . . 0.0 114.646 -174.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -79.12 -26.29 42.88 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.158 1.783 . . . . 0.0 112.685 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -69.17 162.71 26.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.65 1.18 . . . . 0.0 112.624 -169.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -94.82 131.4 40.74 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.2 tp -52.29 -35.81 51.28 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -166.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.267 5.0 m-85 -82.55 -5.45 58.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.351 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 60.5 p -60.49 -27.81 67.87 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 120.168 -1.583 . . . . 0.0 111.357 168.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -70.6 -4.11 21.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.512 1.525 . . . . 0.0 114.114 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -32.2 40.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.994 1.717 . . . . 0.0 111.316 169.187 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -72.7 -25.45 61.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.089 1.356 . . . . 0.0 112.176 -171.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -76.19 -31.59 58.55 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -167.761 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 21.0 t -94.26 99.51 11.74 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 120.672 -1.268 . . . . 0.0 113.689 -166.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.32 -33.6 63.45 Favored 'General case' 0 CA--C 1.554 1.123 0 O-C-N 120.827 -1.17 . . . . 0.0 110.911 169.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.43 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 13.5 mtmt -62.54 -37.77 87.41 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.679 1.992 . . . . 0.0 114.199 176.423 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -106.63 12.82 28.91 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.927 1.291 . . . . 0.0 112.672 -178.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 60.2 ttm -58.48 132.17 52.93 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 121.108 -0.995 . . . . 0.0 108.5 169.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 11.7 p -74.56 172.35 12.17 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.218 -0.926 . . . . 0.0 111.765 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.58 -36.22 73.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.94 170.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -63.67 -35.89 82.05 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.361 0.982 . . . . 0.0 112.462 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.01 -34.75 50.53 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.921 1.288 . . . . 0.0 111.885 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 92' ' ' PHE . . . . . 0.538 ' HA ' HD12 ' B' ' 95' ' ' LEU . 93.6 t80 -68.7 -37.13 79.29 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.964 -1.085 . . . . 0.0 113.52 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.4 pt -77.64 3.8 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 O-C-N 120.844 -1.16 . . . . 0.0 112.026 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -120.03 -32.24 4.24 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -177.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' B' ' 92' ' ' PHE . 0.0 OUTLIER -64.42 162.81 14.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.231 1.832 . . . . 0.0 111.906 172.862 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.491 HD21 ' HD3' ' B' ' 98' ' ' LYS . 48.5 t-20 -63.69 132.22 95.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.805 -168.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.0 -22.22 29.92 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.029 3.153 . . . . 0.0 115.378 176.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.491 ' HD3' HD21 ' B' ' 96' ' ' ASN . 14.6 mttt -56.64 -59.83 4.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.125 1.77 . . . . 0.0 109.365 167.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.75 -14.74 47.35 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 30.5 ttm -53.92 -36.18 62.48 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.947 0.899 . . . . 0.0 111.197 168.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 28.4 m -65.97 -57.65 13.01 Favored Pre-proline 0 N--CA 1.479 0.986 0 CA-C-O 117.862 -1.066 . . . . 0.0 112.818 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -51.23 -41.79 56.68 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.983 3.122 . . . . 0.0 115.188 170.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.92 -37.8 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.606 1.094 . . . . 0.0 113.289 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.16 -33.91 76.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.234 0.613 . . . . 0.0 111.047 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 84.6 t90 -75.91 -50.38 15.17 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-O 117.722 -1.132 . . . . 0.0 112.349 175.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.436 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 1.5 t90 -67.06 -25.51 66.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 117.924 -1.51 . . . . 0.0 111.16 -170.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 54.9 ttp -60.97 -53.36 58.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.638 1.175 . . . . 0.0 111.319 168.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.846 0 C-N-CA 124.775 1.23 . . . . 0.0 112.411 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 119.421 -0.323 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.9 mt -57.17 -27.13 61.64 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.756 0.707 . . . . 0.0 112.624 174.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.4 m -81.08 -37.84 28.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.492 1.117 . . . . 0.0 111.783 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -84.47 -29.95 25.64 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.895 1.442 . . . . 0.0 114.895 -175.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.15 -44.51 98.6 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 120.489 1.495 . . . . 0.0 112.111 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.27 -35.64 18.34 Favored 'Trans proline' 0 C--N 1.353 0.781 0 CA-C-N 122.205 1.823 . . . . 0.0 113.718 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.76 -38.66 91.45 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.453 1.479 . . . . 0.0 112.869 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 m -69.09 -29.19 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.41 -52.15 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.08 0.952 . . . . 0.0 109.9 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -58.19 -42.83 86.97 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.814 0.846 . . . . 0.0 112.386 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -68.32 -27.64 66.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.809 0.844 . . . . 0.0 112.454 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.46 -48.92 15.93 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.364 -0.835 . . . . 0.0 112.906 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -24.93 66.06 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -75.42 -23.36 56.99 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 170.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -138.6 71.95 43.59 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.603 1.161 . . . . 0.0 111.997 172.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -59.14 -16.96 36.14 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.615 2.877 . . . . 0.0 116.772 -172.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -78.33 -16.98 57.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.596 1.158 . . . . 0.0 113.32 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -71.91 164.96 25.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.017 1.327 . . . . 0.0 111.717 -174.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -80.7 159.18 25.34 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 110.366 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.58 -64.82 0.91 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.775 -0.578 . . . . 0.0 112.395 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.43 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 2.7 m-85 -62.49 -21.3 65.38 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -167.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.8 t -55.87 -26.17 45.75 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.477 -0.764 . . . . 0.0 112.31 171.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -64.71 -2.29 2.39 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.823 -1.798 . . . . 0.0 113.748 173.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -72.28 -34.74 68.42 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.668 1.122 . . . . 0.0 111.839 165.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.52 -32.95 73.01 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -167.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 151' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' B' ' 151' ' ' GLN . 8.1 pt20 -73.55 -28.02 61.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.127 2.171 . . . . 0.0 115.706 175.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -165.857 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 pm0 . . . . . 0 N--CA 1.442 -0.828 0 CA-C-O 123.263 1.506 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.502 ' H ' ' HG3' ' B' ' 98' ' ' LYS . 26.8 t -148.4 88.5 1.64 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 113.853 -1.522 . . . . 0.0 109.335 167.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' B' ' 98' ' ' LYS . . . -57.69 -31.74 66.67 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.653 -1.279 . . . . 0.0 110.74 171.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 8.9 mttt -50.12 -49.55 51.44 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.602 1.961 . . . . 0.0 111.728 170.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -100.71 16.43 24.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.287 1.435 . . . . 0.0 113.842 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -55.83 124.13 16.52 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 167.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.5 t -75.48 153.12 37.73 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 120.9 -1.125 . . . . 0.0 110.141 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.23 -32.7 73.41 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.063 -1.648 . . . . 0.0 112.935 -175.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -64.93 -31.0 72.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.91 0.884 . . . . 0.0 112.606 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -77.96 -37.7 46.88 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.193 1.397 . . . . 0.0 111.556 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.98 -49.41 77.77 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.455 -0.778 . . . . 0.0 112.885 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.3 pt -68.42 -5.79 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.669 1.188 . . . . 0.0 113.152 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -110.6 -8.45 14.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.811 1.644 . . . . 0.0 113.74 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.92 159.54 32.65 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 121.057 -1.027 . . . . 0.0 110.329 175.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -65.43 128.65 93.98 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 121.19 -0.944 . . . . 0.0 111.837 -173.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.62 -15.56 12.66 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.777 2.985 . . . . 0.0 115.567 178.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -62.5 -72.41 0.13 Allowed 'General case' 0 C--N 1.349 0.557 0 C-N-CA 126.423 1.889 . . . . 0.0 109.463 166.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.51 -4.11 43.95 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -177.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.9 ttt -58.18 -39.95 80.22 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 112.92 170.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.263 20.1 m -66.21 -51.39 44.85 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -50.16 -45.12 34.92 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.453 2.768 . . . . 0.0 115.841 169.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 p -73.69 -39.0 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.204 0.911 . . . . 0.0 113.358 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.72 -26.3 68.61 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.197 0.999 . . . . 0.0 111.676 172.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 65.5 t90 -83.61 -51.78 7.01 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.378 171.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.453 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.9 t90 -66.02 -34.85 79.03 Favored 'General case' 0 C--N 1.348 0.521 0 CA-C-N 120.329 1.422 . . . . 0.0 112.026 -167.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -55.85 -38.82 70.58 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.694 1.198 . . . . 0.0 112.168 171.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 125.257 1.423 . . . . 0.0 112.853 -169.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.33 -29.29 68.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.591 0.756 . . . . 0.0 112.259 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.7 m -78.74 -34.05 46.1 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.871 1.268 . . . . 0.0 111.857 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -79.14 -26.56 42.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.466 -1.254 . . . . 0.0 113.139 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mm -53.74 -46.13 98.49 Favored Pre-proline 0 N--CA 1.479 0.976 0 CA-C-N 120.327 1.421 . . . . 0.0 112.76 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.22 -37.24 14.57 Favored 'Trans proline' 0 C--N 1.352 0.731 0 CA-C-N 121.701 1.643 . . . . 0.0 113.141 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.88 -37.3 85.76 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.829 -1.169 . . . . 0.0 113.364 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.72 -16.96 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.221 0.608 . . . . 0.0 112.582 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mt -85.12 -49.69 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 124.238 1.015 . . . . 0.0 110.232 171.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -57.47 -39.62 76.76 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.949 0.9 . . . . 0.0 111.758 176.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -71.38 -23.63 61.93 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.19 -0.943 . . . . 0.0 111.67 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -81.09 -44.2 18.34 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.051 -1.031 . . . . 0.0 112.151 175.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -27.4 69.28 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 120.549 1.522 . . . . 0.0 113.698 172.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -71.76 -35.79 70.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -126.98 62.2 50.77 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.876 1.27 . . . . 0.0 111.376 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.96 -17.15 10.28 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.707 3.605 . . . . 0.0 116.071 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -83.28 -22.9 32.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.589 1.555 . . . . 0.0 113.183 -176.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -68.53 159.24 32.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.077 0.951 . . . . 0.0 112.473 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -97.54 118.15 33.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 -175.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -43.24 -43.88 5.01 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -165.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.443 ' CG ' ' HA ' ' A' ' 6' ' ' LYS 0.251 4.3 m-30 -72.01 -8.23 53.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 120.445 1.475 . . . . 0.0 114.06 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.2 p -58.74 -27.48 64.98 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 120.255 -1.528 . . . . 0.0 111.838 167.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -70.54 -11.67 61.08 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.581 -1.324 . . . . 0.0 112.664 177.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -68.8 -30.68 69.3 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.516 1.127 . . . . 0.0 112.057 169.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -69.41 -16.67 63.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 112.003 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -79.79 -26.37 40.62 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.266 2.226 . . . . 0.0 114.396 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -163.338 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t 102.79 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 129.525 3.13 . . . . 0.0 116.975 166.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.7 -39.73 68.47 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.391 -1.443 . . . . 0.0 111.287 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.424 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 4.4 ptpt -77.08 1.65 17.45 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -127.08 6.84 6.53 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.084 1.354 . . . . 0.0 112.64 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 33.4 ttm -62.2 137.43 58.25 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.778 -1.201 . . . . 0.0 110.046 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 22.2 p -74.18 167.51 21.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.124 0.964 . . . . 0.0 111.727 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.73 -36.28 73.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.826 170.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -63.12 -36.96 85.35 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.161 0.891 . . . . 0.0 112.58 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -75.86 -38.72 57.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.941 0.896 . . . . 0.0 111.874 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -59.94 -45.38 92.81 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.189 -0.944 . . . . 0.0 113.08 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -71.45 -0.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 118.89 0.768 . . . . 0.0 112.665 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -119.03 -14.77 9.33 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 126.331 1.853 . . . . 0.0 114.949 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.64 159.15 13.8 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.956 1.253 . . . . 0.0 111.234 173.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -73.31 130.7 83.96 Favored Pre-proline 0 N--CA 1.482 1.151 0 O-C-N 120.72 -1.238 . . . . 0.0 110.263 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -58.18 -26.93 78.35 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 121.69 1.593 . . . . 0.0 114.445 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.502 ' HG3' ' H ' ' A' ' 4' ' ' SER . 6.5 mptt -56.7 -15.07 3.88 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 121.459 1.936 . . . . 0.0 114.604 175.612 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -123.38 21.37 9.51 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 122.791 2.541 . . . . 0.0 114.61 167.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 35.7 ttm -73.42 -57.84 3.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.44 1.496 . . . . 0.0 112.503 172.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.6 m -49.58 -52.35 51.11 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.35 -45.26 40.74 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.996 3.13 . . . . 0.0 115.792 172.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.2 p -75.63 -39.84 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 120.749 1.613 . . . . 0.0 112.785 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.82 -31.58 69.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.776 0.83 . . . . 0.0 111.252 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 37.5 t90 -83.06 -47.18 11.95 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.556 -1.211 . . . . 0.0 112.102 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.413 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -68.84 -24.1 64.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 121.208 1.822 . . . . 0.0 111.128 -170.159 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.09 -46.91 79.14 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.935 1.294 . . . . 0.0 111.51 169.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.6 mm? . . . . . 0 CA--C 1.548 0.872 0 C-N-CA 125.173 1.389 . . . . 0.0 113.187 173.359 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 76.0 mt -52.82 -34.91 56.03 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.264 1.025 . . . . 0.0 113.009 174.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 58.7 m -75.72 -33.15 60.29 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.375 0.67 . . . . 0.0 111.596 175.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -81.03 -25.1 37.43 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 179.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.1 mm -54.42 -44.35 98.75 Favored Pre-proline 0 CA--C 1.555 1.161 0 CA-C-N 120.187 1.358 . . . . 0.0 112.173 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.98 -34.38 10.59 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.821 1.686 . . . . 0.0 113.204 171.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -66.1 -32.39 73.82 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.659 -1.276 . . . . 0.0 113.604 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.09 -25.9 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.663 0.665 . . . . 0.0 112.481 173.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.5 mt -73.62 -53.06 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.797 0.839 . . . . 0.0 109.546 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.42 -44.21 84.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.935 0.894 . . . . 0.0 112.184 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -71.44 -24.48 62.03 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.99 -1.069 . . . . 0.0 112.172 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.88 -46.01 22.57 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.118 -0.989 . . . . 0.0 112.055 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -26.03 68.59 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 120.28 1.4 . . . . 0.0 113.778 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -72.85 -32.34 65.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 168.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -129.34 60.51 51.62 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.22 1.408 . . . . 0.0 111.11 -175.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -60.17 -17.07 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.747 2.965 . . . . 0.0 115.424 -169.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -80.39 -18.01 50.18 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.668 1.187 . . . . 0.0 113.355 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -71.79 165.97 22.99 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.252 1.021 . . . . 0.0 112.429 -172.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -92.49 130.82 38.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 55.0 tp -46.71 -34.51 5.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.271 1.828 . . . . 0.0 114.092 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.424 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.2 m-85 -84.66 -8.71 58.77 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.6 p -62.81 -25.59 68.32 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.564 -1.335 . . . . 0.0 111.391 168.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -71.5 -2.98 18.7 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.28 1.432 . . . . 0.0 114.204 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -32.17 41.35 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.942 1.297 . . . . 0.0 111.277 167.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -72.44 -31.04 65.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.639 1.176 . . . . 0.0 112.431 -169.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -67.82 -30.0 69.3 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.701 1.6 . . . . 0.0 114.662 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -167.28 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t 93.42 98.85 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.571 2.748 . . . . 0.0 117.217 165.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.27 -30.33 66.5 Favored 'General case' 0 CA--C 1.556 1.19 0 O-C-N 120.211 -1.556 . . . . 0.0 112.06 172.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 11.1 mtmt -64.91 -20.51 66.48 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.821 1.649 . . . . 0.0 114.869 173.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -114.5 7.36 16.17 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.035 1.334 . . . . 0.0 113.053 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -63.12 123.93 19.85 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.68 -1.263 . . . . 0.0 109.771 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.62 155.35 29.62 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.156 -0.965 . . . . 0.0 110.379 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -63.5 -33.46 75.64 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 120.247 -1.533 . . . . 0.0 113.291 -174.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.13 -32.99 73.64 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 171.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -78.93 -36.42 41.8 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.123 1.369 . . . . 0.0 111.774 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.09 -49.31 78.17 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.402 -0.811 . . . . 0.0 112.502 177.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -68.51 -2.54 2.03 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 124.743 1.217 . . . . 0.0 112.856 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -113.49 -11.1 13.12 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.872 1.669 . . . . 0.0 113.826 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.23 155.64 38.32 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 121.116 -0.99 . . . . 0.0 110.726 172.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -68.36 132.82 91.35 Favored Pre-proline 0 N--CA 1.48 1.043 0 O-C-N 121.052 -1.03 . . . . 0.0 111.231 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -45.49 -35.42 12.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.304 3.336 . . . . 0.0 114.466 175.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' B' ' 83' ' ' SER . 38.7 mttt -61.2 -19.06 61.17 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -127.52 19.53 6.78 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.655 1.57 . . . . 0.0 114.207 166.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 47.6 mtp -65.79 -58.73 4.95 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.784 0.833 . . . . 0.0 111.961 168.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 m -40.96 -55.31 4.86 Favored Pre-proline 0 N--CA 1.494 1.755 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -58.04 -39.43 85.9 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 123.791 2.994 . . . . 0.0 115.806 175.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.8 -38.4 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.807 1.185 . . . . 0.0 112.632 174.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.96 -21.35 66.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.303 1.041 . . . . 0.0 111.573 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.452 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 70.9 t90 -92.36 -49.12 6.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 116.986 -1.483 . . . . 0.0 112.973 168.602 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -69.27 -22.87 63.79 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 121.744 2.065 . . . . 0.0 112.512 -169.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.0 tmm? -70.76 -34.42 71.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.327 -0.858 . . . . 0.0 111.592 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 C-N-CA 125.953 1.701 . . . . 0.0 111.99 -177.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 C--O 1.221 -0.418 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.97 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.76 -23.03 66.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.376 0.989 . . . . 0.0 111.433 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.0 m -79.43 -37.3 37.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.055 0.942 . . . . 0.0 111.529 169.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -85.96 -27.06 25.14 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.26 -42.07 89.46 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-N 120.455 1.48 . . . . 0.0 112.385 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.58 -37.79 6.79 Favored 'Trans proline' 0 C--N 1.355 0.911 0 CA-C-N 121.97 1.739 . . . . 0.0 113.186 169.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt -66.81 -32.67 74.1 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.225 -1.547 . . . . 0.0 113.839 -176.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.7 m -69.07 -20.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 119.011 0.823 . . . . 0.0 112.949 173.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.0 mt -83.95 -51.04 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.043 0.937 . . . . 0.0 110.023 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.45 -38.84 78.34 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.152 0.981 . . . . 0.0 111.969 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.94 -30.28 68.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.556 0.616 . . . . 0.0 111.305 177.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -76.62 -42.51 42.02 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 120.934 -1.104 . . . . 0.0 113.072 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.71 -29.62 68.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 120.877 1.671 . . . . 0.0 113.914 177.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -80.11 -29.19 38.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -129.81 70.74 82.13 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.521 1.528 . . . . 0.0 111.121 174.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -59.53 -11.74 15.02 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.859 3.706 . . . . 0.0 116.254 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -83.69 -21.48 32.37 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.355 1.462 . . . . 0.0 113.146 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -69.1 157.4 36.91 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.113 0.965 . . . . 0.0 111.49 -174.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -94.39 134.54 36.78 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.8 tp -51.85 -38.85 57.54 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -168.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.448 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 5.2 m-85 -79.6 -5.88 55.92 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.7 p -61.41 -27.58 68.64 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.043 -1.661 . . . . 0.0 110.948 167.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.41 -2.91 24.28 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.417 1.487 . . . . 0.0 113.487 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -31.48 37.53 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.548 1.539 . . . . 0.0 111.714 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -70.22 -26.66 63.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.742 1.217 . . . . 0.0 112.198 -171.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -79.34 -31.16 42.98 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.763 1.625 . . . . 0.0 115.056 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.545 0 C-N-CA 124.614 1.165 . . . . 0.0 113.602 -167.27 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.427 -1.616 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 83' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 19' ' ' LYS . 20.2 m -137.03 56.53 1.79 Allowed 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 124.032 0.933 . . . . 0.0 109.26 168.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.68 -39.79 68.45 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.546 -1.347 . . . . 0.0 109.677 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.452 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 2.4 ptpt -68.18 -6.31 22.69 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.449 2.699 . . . . 0.0 116.527 175.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -138.42 18.4 2.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.495 1.518 . . . . 0.0 112.143 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 87' ' ' MET . . . . . 0.428 ' HE1' HD22 ' B' ' 95' ' ' LEU . 23.4 ttm -60.09 123.76 18.13 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 120.023 1.283 . . . . 0.0 108.143 177.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.8 t -76.6 152.15 36.0 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.065 -175.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.195 -1.566 . . . . 0.0 112.763 -170.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -32.42 71.92 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 119.34 0.973 . . . . 0.0 112.38 173.5 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.41 -37.3 63.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.538 1.535 . . . . 0.0 111.231 174.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -64.01 -49.75 71.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.652 1.181 . . . . 0.0 113.203 175.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.0 pt -68.66 -3.88 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 176.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -103.78 -10.13 18.51 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.073 1.749 . . . . 0.0 114.053 169.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 95' ' ' LEU . . . . . 0.428 HD22 ' HE1' ' B' ' 87' ' ' MET . 0.2 OUTLIER -70.77 160.76 32.11 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.702 -1.249 . . . . 0.0 110.464 171.006 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.448 HD21 ' HD2' ' B' ' 98' ' ' LYS . 53.8 t-20 -69.44 130.47 90.75 Favored Pre-proline 0 N--CA 1.481 1.122 0 O-C-N 121.376 -0.827 . . . . 0.0 111.942 -178.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.13 -19.95 35.79 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.57 2.847 . . . . 0.0 115.614 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.448 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.8 mttt -55.81 -66.19 0.47 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.487 1.915 . . . . 0.0 110.386 168.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.37 -6.57 59.4 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.6 ttm -58.37 -38.02 76.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.97 -1.081 . . . . 0.0 111.313 168.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 63.3 m -60.48 -56.75 32.21 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 124.346 1.058 . . . . 0.0 112.598 -177.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -52.85 -44.61 46.95 Favored 'Trans proline' 0 C--N 1.357 1.001 0 C-N-CA 124.187 3.258 . . . . 0.0 115.408 171.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.21 -37.21 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 120.442 1.474 . . . . 0.0 112.896 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.79 -24.93 67.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.629 0.771 . . . . 0.0 110.975 175.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.505 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.4 t90 -83.14 -51.16 7.75 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.496 168.591 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.505 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.3 t90 -64.98 -33.55 76.31 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.673 1.579 . . . . 0.0 111.278 -168.046 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -57.17 -44.24 83.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.734 1.214 . . . . 0.0 112.352 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.732 0 C-N-CA 125.294 1.438 . . . . 0.0 111.909 -173.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.8 mt -58.13 -30.5 66.38 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.251 1.02 . . . . 0.0 112.515 175.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 91.2 m -80.29 -37.19 33.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.587 1.155 . . . . 0.0 112.104 174.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -74.15 -31.88 62.9 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.519 -1.363 . . . . 0.0 113.602 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.59 -51.84 75.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 120.068 1.304 . . . . 0.0 112.208 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.64 -33.19 36.48 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 CA-C-N 121.922 1.722 . . . . 0.0 113.5 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -62.99 -41.43 99.57 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.625 1.557 . . . . 0.0 113.008 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.44 -28.35 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.832 -0.542 . . . . 0.0 112.427 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 54.6 mt -67.23 -47.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.302 0.501 . . . . 0.0 110.318 172.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -57.99 -44.31 87.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.857 0.863 . . . . 0.0 111.624 172.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.73 -23.45 63.2 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.942 -1.099 . . . . 0.0 113.173 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.34 -51.12 8.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.626 1.103 . . . . 0.0 112.434 175.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -26.65 68.51 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 120.614 1.552 . . . . 0.0 113.508 173.366 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -73.02 -29.79 63.27 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.467 1.507 . . . . 0.0 114.663 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -131.63 64.87 74.45 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.51 -15.35 40.73 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.851 3.034 . . . . 0.0 116.483 -168.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -84.33 -12.84 53.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.561 1.144 . . . . 0.0 114.051 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -77.48 163.54 26.24 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.726 1.21 . . . . 0.0 112.529 -170.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -79.18 143.89 34.97 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.837 -0.54 . . . . 0.0 109.813 169.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.78 -39.51 85.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.452 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 3.0 m-30 -82.65 -26.7 31.92 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.9 t -61.58 -19.18 61.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.903 -1.123 . . . . 0.0 112.187 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.68 -4.19 1.9 Allowed 'General case' 0 CA--C 1.538 0.518 0 O-C-N 119.554 -1.966 . . . . 0.0 113.957 171.076 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -33.68 71.58 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.554 1.07 . . . . 0.0 111.965 166.399 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.01 -32.42 73.78 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -167.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 151' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' B' ' 151' ' ' GLN . 8.3 pt20 -71.06 -28.2 64.19 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.744 2.018 . . . . 0.0 115.154 172.274 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -167.34 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.553 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.422 -1.852 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.429 ' H ' ' HG2' ' B' ' 98' ' ' LYS . 17.3 m -128.94 57.58 1.62 Allowed 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 123.402 0.681 . . . . 0.0 109.947 169.072 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.553 ' H ' ' HG2' ' A' ' 3' ' ' GLU . . . -53.35 -40.64 65.08 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.166 1.348 . . . . 0.0 109.414 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.469 ' HA ' ' CD2' ' A' ' 67' ' ' TYR . 3.0 mppt? -45.39 -29.03 0.97 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 130.592 3.557 . . . . 0.0 114.893 169.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -134.77 21.99 3.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.963 1.705 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.526 ' HE1' HD22 ' A' ' 16' ' ' LEU . 20.4 ttm -60.05 120.02 8.91 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.3 t -74.97 152.1 38.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -173.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.35 -28.4 69.26 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.624 -1.297 . . . . 0.0 113.165 -170.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.41 90.94 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.886 0.766 . . . . 0.0 111.595 169.248 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -70.47 -37.14 74.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.257 1.023 . . . . 0.0 111.949 175.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -59.38 -52.29 66.27 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.349 -0.845 . . . . 0.0 112.812 174.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.2 pt -69.87 0.93 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 112.627 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -112.61 -14.76 13.14 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.072 1.749 . . . . 0.0 114.02 173.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.526 HD22 ' HE1' ' A' ' 8' ' ' MET . 0.3 OUTLIER -67.03 162.72 21.51 Favored 'General case' 0 CA--C 1.552 1.049 0 O-C-N 120.88 -1.137 . . . . 0.0 110.127 169.778 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.519 HD21 ' HD3' ' A' ' 19' ' ' LYS . 50.4 t-20 -68.22 129.93 92.68 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 120.823 -1.173 . . . . 0.0 112.409 -175.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 38.8 Cg_exo -58.81 -12.31 14.45 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.269 3.312 . . . . 0.0 116.15 176.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.519 ' HD3' HD21 ' A' ' 17' ' ' ASN . 7.6 mttt -65.37 -63.06 1.19 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.334 1.854 . . . . 0.0 108.669 166.579 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.62 0.92 44.75 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 72.8 mtp -59.54 -38.5 81.22 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.818 -1.176 . . . . 0.0 112.116 169.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 21.8 m -66.64 -51.53 39.97 Favored Pre-proline 0 N--CA 1.48 1.045 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -49.5 -46.75 25.32 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.66 2.907 . . . . 0.0 116.132 169.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.09 -39.65 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 120.954 -1.091 . . . . 0.0 112.765 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.12 -27.33 68.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.558 0.743 . . . . 0.0 111.803 173.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 81.1 t90 -83.43 -52.21 6.72 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.727 171.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.434 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.4 t90 -66.05 -34.63 78.53 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 120.213 1.37 . . . . 0.0 111.517 -168.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -56.58 -42.83 79.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.988 1.315 . . . . 0.0 111.731 171.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.546 0.817 0 C-N-CA 125.679 1.592 . . . . 0.0 113.788 175.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 119.373 -0.346 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -61.11 -30.63 70.47 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.41 0.684 . . . . 0.0 112.234 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.1 m -73.78 -38.29 64.71 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.375 0.67 . . . . 0.0 111.39 173.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -82.07 -24.22 35.37 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.667 -175.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.2 mm -52.49 -48.66 89.28 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 120.504 1.502 . . . . 0.0 111.79 177.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.4 -37.59 22.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 CA-C-N 121.484 1.566 . . . . 0.0 113.342 172.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.05 -37.02 84.78 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.671 -1.268 . . . . 0.0 113.292 -175.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.14 -22.19 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.7 mt -81.09 -50.95 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.562 0.745 . . . . 0.0 110.116 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -59.54 -39.61 84.52 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.08 0.952 . . . . 0.0 112.008 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.75 -30.33 70.52 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 122.952 0.501 . . . . 0.0 111.373 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.68 -46.89 28.74 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 174.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -29.97 68.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 121.094 1.77 . . . . 0.0 114.145 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.88 -34.52 60.0 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -132.04 78.08 70.1 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.506 1.123 . . . . 0.0 111.932 171.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -54.58 -12.57 4.49 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.844 3.696 . . . . 0.0 117.462 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.32 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.229 1.412 . . . . 0.0 112.817 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -66.07 159.5 25.91 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 113.1 -171.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -84.13 138.84 32.81 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.636 -0.665 . . . . 0.0 109.389 169.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.22 -34.33 66.21 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 172.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -85.36 -29.66 24.28 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 115.558 1.688 . . . . 0.0 115.558 -173.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.7 t -64.28 -12.48 41.94 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.11 -0.994 . . . . 0.0 112.078 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -66.34 -3.69 6.46 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 119.662 -1.899 . . . . 0.0 113.737 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 -30.55 32.94 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.431 1.492 . . . . 0.0 111.955 167.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -66.68 -28.52 68.52 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.11 1.364 . . . . 0.0 112.074 -173.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.05 -30.01 55.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 114.79 173.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -166.63 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.968 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 11.6 t 103.98 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 129.552 3.141 . . . . 0.0 114.343 169.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -33.7 71.84 Favored 'General case' 0 CA--C 1.554 1.099 0 O-C-N 120.522 -1.361 . . . . 0.0 110.711 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -41.25 74.95 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.104 2.162 . . . . 0.0 113.454 173.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.77 8.16 39.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.066 1.347 . . . . 0.0 113.297 -174.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.0 ttm -62.59 123.08 17.43 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 109.904 172.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -77.78 155.34 31.2 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.041 -1.037 . . . . 0.0 110.494 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.84 -32.84 74.14 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.274 -1.516 . . . . 0.0 112.984 -174.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.85 -31.65 72.9 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.871 0.76 . . . . 0.0 112.871 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -80.18 -36.63 34.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.306 1.443 . . . . 0.0 111.357 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -61.45 -48.55 80.64 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.784 0.834 . . . . 0.0 112.611 175.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.45 -1.43 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 123.73 0.812 . . . . 0.0 113.163 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -110.56 -9.29 14.56 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.38 1.872 . . . . 0.0 114.076 172.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 155.72 40.08 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 119.875 1.216 . . . . 0.0 110.702 174.08 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -67.75 130.84 92.84 Favored Pre-proline 0 N--CA 1.479 0.982 0 O-C-N 121.292 -0.88 . . . . 0.0 110.624 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -46.58 -35.06 16.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.193 3.262 . . . . 0.0 114.117 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.429 ' HG2' ' H ' ' A' ' 4' ' ' SER . 59.3 mttt -60.39 -14.8 20.85 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -132.92 19.01 4.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.891 1.678 . . . . 0.0 112.609 166.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.1 ttm -70.0 -52.01 27.68 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.802 1.241 . . . . 0.0 110.88 169.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 2.7 m -45.76 -56.62 9.63 Favored Pre-proline 0 N--CA 1.489 1.519 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.88 -43.29 58.49 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.052 3.168 . . . . 0.0 115.389 175.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.39 -38.3 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.184 1.356 . . . . 0.0 112.724 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.04 -26.99 68.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.99 0.916 . . . . 0.0 111.042 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.507 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.7 t90 -84.01 -52.87 5.97 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.294 168.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.507 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.8 t90 -64.33 -31.18 72.28 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 120.048 1.295 . . . . 0.0 112.683 -166.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -61.61 -49.31 77.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.592 1.157 . . . . 0.0 111.406 172.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.548 0.866 0 C-N-CA 125.492 1.517 . . . . 0.0 111.802 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 . . . . . 0 N--CA 1.47 0.549 0 CA-C-O 119.458 -0.306 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.72 -23.13 65.94 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -82.96 -33.26 26.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 119.284 -0.388 . . . . 0.0 112.021 172.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.64 -27.38 29.16 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.01 -42.43 85.29 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 120.599 1.545 . . . . 0.0 113.495 176.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.39 -35.07 5.23 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 CA-C-N 122.438 1.906 . . . . 0.0 113.476 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -66.69 -32.12 73.23 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.261 -1.525 . . . . 0.0 113.42 -176.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.26 -29.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.721 -0.612 . . . . 0.0 112.122 172.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -71.26 -49.42 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.47 0.708 . . . . 0.0 110.151 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -57.56 -41.69 81.52 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.426 0.69 . . . . 0.0 111.995 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -67.94 -34.67 77.04 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 118.986 0.812 . . . . 0.0 112.295 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.14 -44.62 68.48 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.263 -0.898 . . . . 0.0 112.413 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -29.29 65.35 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.446 1.475 . . . . 0.0 114.865 179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -76.38 -27.44 56.39 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 170.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -132.97 73.05 76.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.019 1.328 . . . . 0.0 111.636 172.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -59.22 -11.57 13.53 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.037 3.158 . . . . 0.0 116.279 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -81.37 -23.19 37.85 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.78 1.632 . . . . 0.0 113.916 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -65.33 157.54 28.87 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.831 1.252 . . . . 0.0 111.279 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -96.07 133.61 40.12 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 118.322 -0.847 . . . . 0.0 109.289 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.8 tp -50.62 -38.52 46.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -168.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.273 4.8 m-85 -82.33 -1.02 48.36 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -177.335 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 62.4 p -64.99 -32.15 73.73 Favored 'General case' 0 N--CA 1.483 1.214 0 O-C-N 120.582 -1.324 . . . . 0.0 110.925 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -69.73 -1.87 10.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.415 1.486 . . . . 0.0 113.649 -176.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -77.7 -38.7 46.82 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.84 1.656 . . . . 0.0 112.244 167.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -27.62 64.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -167.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -70.28 -29.2 65.9 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.018 1.727 . . . . 0.0 114.581 170.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -167.959 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.8 t -99.37 92.69 5.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.699 1.2 . . . . 0.0 113.073 -165.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.13 -31.28 67.03 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.524 -1.36 . . . . 0.0 111.359 176.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.2 ptpt -74.52 -10.2 59.32 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 177.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -121.03 14.78 11.52 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.049 1.339 . . . . 0.0 111.821 168.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.42 118.95 7.62 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.855 -1.153 . . . . 0.0 108.016 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -76.53 154.87 34.18 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.176 -0.953 . . . . 0.0 109.672 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.15 -32.64 74.07 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.455 -1.403 . . . . 0.0 113.197 -172.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -62.82 -33.77 75.91 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 170.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -77.12 -37.16 54.67 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.071 1.349 . . . . 0.0 111.361 175.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -60.0 -50.15 74.88 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 121.469 -0.769 . . . . 0.0 112.353 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.8 pt -69.41 -2.84 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 124.561 1.144 . . . . 0.0 112.981 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -106.02 -12.11 15.91 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.249 1.42 . . . . 0.0 113.738 172.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.59 165.87 23.85 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.119 0.968 . . . . 0.0 110.474 170.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.509 HD21 ' HD3' ' A' ' 19' ' ' LYS . 48.8 t-20 -72.34 131.98 84.43 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.786 -1.196 . . . . 0.0 111.74 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.1 -30.67 41.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.229 3.286 . . . . 0.0 116.077 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.509 ' HD3' HD21 ' A' ' 17' ' ' ASN . 8.2 mttt -51.5 -59.28 4.43 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.456 1.902 . . . . 0.0 108.893 169.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 178.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 78.0 mtp -61.85 -35.38 78.1 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.065 1.302 . . . . 0.0 111.343 169.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 28.2 m -64.38 -54.15 40.36 Favored Pre-proline 0 N--CA 1.48 1.048 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -175.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -52.46 -39.04 75.11 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 123.493 2.796 . . . . 0.0 116.094 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.8 p -78.03 -34.56 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.61 1.095 . . . . 0.0 113.491 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -24.67 67.93 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.334 1.053 . . . . 0.0 110.62 172.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.516 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 68.7 t90 -85.74 -56.46 3.48 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 117.939 -1.029 . . . . 0.0 112.612 168.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.6 t90 -64.88 -28.99 69.92 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 120.655 1.571 . . . . 0.0 112.759 -166.256 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -61.42 -52.12 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.338 1.055 . . . . 0.0 111.357 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.548 0.903 0 C-N-CA 125.839 1.656 . . . . 0.0 111.955 -175.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 120.139 0.019 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.2 mt -65.11 -24.01 67.31 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.778 -0.576 . . . . 0.0 112.541 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.9 m -80.01 -33.4 39.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.922 1.289 . . . . 0.0 111.319 172.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.4 mm100 -82.64 -30.33 29.44 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.729 1.149 . . . . 0.0 113.249 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.7 -41.84 85.98 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 120.277 1.399 . . . . 0.0 113.423 175.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.1 -36.58 7.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 122.392 1.89 . . . . 0.0 113.429 169.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -66.17 -35.15 79.7 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.778 1.626 . . . . 0.0 113.817 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.03 -17.45 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 174.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -88.68 -52.09 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.255 1.022 . . . . 0.0 110.904 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.91 -42.17 71.88 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.082 0.953 . . . . 0.0 110.947 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.15 -30.7 70.76 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.049 -0.407 . . . . 0.0 111.403 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.9 m -74.68 -45.12 46.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.101 -0.952 . . . . 0.0 113.199 174.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.8 69.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 120.883 1.674 . . . . 0.0 114.166 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -82.2 -26.55 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -130.75 75.02 79.42 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 125.606 1.563 . . . . 0.0 110.912 170.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -60.75 -11.28 16.95 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.799 3.666 . . . . 0.0 115.871 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -80.28 -25.37 39.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.832 1.653 . . . . 0.0 112.782 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -69.96 160.51 31.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.43 1.492 . . . . 0.0 111.955 -172.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.62 146.92 26.64 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.561 -0.712 . . . . 0.0 110.058 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 57.1 tp -61.97 -31.63 72.0 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.263 -0.898 . . . . 0.0 113.219 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 2.4 m-85 -89.62 -24.87 21.56 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 -171.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -63.02 -15.43 56.43 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.863 -1.148 . . . . 0.0 112.071 171.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -66.26 -5.89 11.95 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.513 -1.992 . . . . 0.0 113.743 169.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -34.51 60.57 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.44 1.496 . . . . 0.0 111.606 167.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -62.96 -25.13 68.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.176 1.79 . . . . 0.0 112.774 -170.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -85.08 -30.89 23.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.423 1.889 . . . . 0.0 115.955 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 -166.245 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.258 50.1 mm-40 . . . . . 0 CA--C 1.545 0.782 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 101.42 93.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 131.14 3.776 . . . . 0.0 115.008 169.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.14 -34.17 69.97 Favored 'General case' 0 CA--C 1.555 1.136 0 O-C-N 120.383 -1.448 . . . . 0.0 110.641 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.452 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 15.5 mtmt -58.4 -34.75 71.09 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.3 1.84 . . . . 0.0 114.538 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -105.44 8.73 33.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.914 1.285 . . . . 0.0 112.976 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.9 ttm -62.38 123.79 19.2 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.635 1.107 . . . . 0.0 109.662 171.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -76.32 154.7 34.83 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 121.015 -1.053 . . . . 0.0 110.307 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.38 -31.95 73.24 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.162 -1.586 . . . . 0.0 113.187 -173.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -65.29 -32.49 74.17 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.155 0.889 . . . . 0.0 112.933 172.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -77.85 -37.35 48.58 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.303 1.441 . . . . 0.0 111.298 176.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -62.83 -47.69 82.33 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.547 -0.72 . . . . 0.0 112.75 176.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -69.76 -3.53 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -104.49 -10.61 17.54 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.043 1.737 . . . . 0.0 114.251 170.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.69 160.42 32.66 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 119.895 1.225 . . . . 0.0 110.895 173.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 50.3 t-20 -65.72 129.96 94.43 Favored Pre-proline 0 N--CA 1.48 1.062 0 O-C-N 121.118 -0.989 . . . . 0.0 111.571 -178.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 97' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 31.9 Cg_exo -60.43 -17.38 47.39 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.278 2.652 . . . . 0.0 114.783 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 mptt -54.69 -69.39 0.13 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.501 1.52 . . . . 0.0 109.889 168.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 99' ' ' ALA . . . . . 0.427 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -78.87 -11.53 60.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -175.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -54.58 -35.5 63.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 120.618 -1.302 . . . . 0.0 112.532 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 32.4 m -61.87 -57.8 21.93 Favored Pre-proline 0 N--CA 1.483 1.208 0 CA-C-O 117.719 -1.134 . . . . 0.0 113.542 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -53.95 -37.1 85.68 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.97 3.114 . . . . 0.0 114.244 169.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 103' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 99' ' ' ALA . 55.9 t -62.71 -50.14 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.562 -0.711 . . . . 0.0 111.534 174.096 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.11 -40.28 95.87 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.185 0.994 . . . . 0.0 109.897 -176.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.489 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 75.1 t90 -68.36 -49.65 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 116.991 -1.481 . . . . 0.0 112.592 172.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.85 -26.41 65.13 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 121.416 1.916 . . . . 0.0 111.268 -170.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -63.29 -48.83 76.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.385 1.074 . . . . 0.0 111.045 169.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.791 0 C-N-CA 124.865 1.266 . . . . 0.0 112.172 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -59.31 -30.43 68.33 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.767 0.827 . . . . 0.0 112.423 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 86.8 m -78.75 -36.89 42.45 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.426 1.09 . . . . 0.0 111.625 174.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -78.66 -32.65 47.28 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.947 -1.095 . . . . 0.0 113.741 -176.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.41 -45.24 95.26 Favored Pre-proline 0 N--CA 1.481 1.087 0 CA-C-N 120.364 1.438 . . . . 0.0 113.09 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.69 -34.99 8.31 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 122.228 1.831 . . . . 0.0 113.277 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -66.19 -32.78 74.42 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.329 -1.482 . . . . 0.0 113.983 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 23.0 m -71.59 -27.19 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 121.798 -0.564 . . . . 0.0 111.878 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -72.3 -47.29 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.463 0.705 . . . . 0.0 110.131 170.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -57.88 -41.06 81.73 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.697 0.799 . . . . 0.0 112.075 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.73 -32.35 74.0 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.279 0.945 . . . . 0.0 112.263 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.37 -47.4 56.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.876 -1.14 . . . . 0.0 112.428 176.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.85 -29.02 66.17 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 120.555 1.525 . . . . 0.0 114.804 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -74.41 -28.53 61.11 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 170.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -134.21 73.91 68.63 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.073 1.349 . . . . 0.0 111.71 173.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -59.93 -11.11 14.02 Favored 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 124.018 3.145 . . . . 0.0 116.033 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -81.0 -22.63 39.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.929 1.692 . . . . 0.0 114.175 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -63.89 155.47 30.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.237 1.415 . . . . 0.0 111.085 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -91.33 133.73 35.19 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.8 tp -51.07 -39.01 55.05 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -168.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.452 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.7 m-85 -81.43 -5.54 58.01 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -176.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 77.0 p -59.22 -27.44 65.75 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.378 -1.451 . . . . 0.0 111.163 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -72.48 -2.48 19.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.209 1.404 . . . . 0.0 113.666 177.27 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -80.31 -32.06 38.06 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.747 1.158 . . . . 0.0 111.748 167.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -64.34 -26.62 68.56 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.201 1.0 . . . . 0.0 112.738 -169.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -77.01 -27.76 54.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.385 2.274 . . . . 0.0 116.149 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -166.09 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.7 t 98.59 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 128.72 2.808 . . . . 0.0 117.361 164.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.9 -34.89 73.78 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 119.88 -1.763 . . . . 0.0 112.091 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -72.12 -4.42 28.93 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 175.09 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.65 5.15 11.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.501 1.52 . . . . 0.0 112.445 169.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.3 ttm -62.56 125.67 24.73 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.641 -1.287 . . . . 0.0 109.54 175.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.71 154.79 29.8 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.402 -0.811 . . . . 0.0 110.496 179.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.03 -34.11 75.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.413 -1.429 . . . . 0.0 113.083 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.49 -31.86 73.15 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.715 0.806 . . . . 0.0 112.871 172.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -78.44 -38.13 42.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.958 1.303 . . . . 0.0 111.697 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -58.81 -50.03 75.47 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.533 0.733 . . . . 0.0 112.452 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.0 pt -67.86 -7.18 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.43 1.092 . . . . 0.0 112.98 177.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.51 -7.95 17.28 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.85 1.66 . . . . 0.0 113.607 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.23 159.29 32.7 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 110.702 175.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 51.9 t-20 -64.93 128.87 94.16 Favored Pre-proline 0 N--CA 1.483 1.184 0 O-C-N 121.222 -0.924 . . . . 0.0 112.088 -173.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 31.2 Cg_exo -56.91 -16.58 20.82 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.838 3.026 . . . . 0.0 115.247 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -61.71 -69.71 0.23 Allowed 'General case' 0 C--N 1.348 0.524 0 C-N-CA 125.819 1.648 . . . . 0.0 110.15 167.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.28 -3.12 48.09 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.5 ttt -58.91 -36.65 75.07 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 169.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -65.43 -51.5 51.55 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.422 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 5.8 Cg_endo -51.55 -47.71 24.87 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.048 2.499 . . . . 0.0 114.904 169.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 p -67.36 -37.53 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.788 -1.195 . . . . 0.0 113.162 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.46 -17.34 63.74 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.158 0.983 . . . . 0.0 112.854 175.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.467 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.7 t90 -97.97 -45.24 6.35 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.922 1.237 . . . . 0.0 111.814 168.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 31.5 t-105 -59.33 -34.29 72.16 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.108 0.963 . . . . 0.0 111.456 -172.243 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -74.13 -51.6 15.13 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.453 169.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 tm? . . . . . 0 CA--C 1.534 0.364 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -168.116 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 . . . . . 0 CA--C 1.536 0.413 0 CA-C-O 119.631 -0.223 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.52 -27.42 69.14 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.806 -1.184 . . . . 0.0 112.185 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 90.8 m -76.06 -36.79 58.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.569 0.747 . . . . 0.0 111.45 170.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -84.56 -27.6 27.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -176.231 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.25 -42.17 85.2 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 120.235 1.38 . . . . 0.0 112.918 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.47 -37.46 5.56 Favored 'Trans proline' 0 C--N 1.352 0.756 0 CA-C-N 122.145 1.802 . . . . 0.0 113.02 169.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -67.84 -33.09 74.09 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.226 -1.546 . . . . 0.0 113.76 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.6 m -68.21 -17.27 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.908 0.776 . . . . 0.0 113.083 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -87.43 -52.1 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.72 1.208 . . . . 0.0 110.186 172.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -56.67 -40.33 75.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.423 1.089 . . . . 0.0 111.838 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -71.96 -24.88 61.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.552 -0.717 . . . . 0.0 111.12 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.95 -43.69 21.63 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.318 -0.864 . . . . 0.0 112.193 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -27.78 69.53 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 120.444 1.475 . . . . 0.0 113.586 172.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -71.59 -37.7 70.96 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 169.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -125.22 63.53 42.64 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.001 1.32 . . . . 0.0 111.353 -176.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.17 -13.48 16.07 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.189 3.259 . . . . 0.0 115.905 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -86.1 -21.12 27.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.765 1.626 . . . . 0.0 113.581 -178.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -70.26 160.18 32.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.933 0.893 . . . . 0.0 112.008 -172.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.58 132.05 39.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.118 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -50.03 -36.61 29.53 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.437 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.5 m-85 -80.52 -9.33 59.77 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.795 -1.19 . . . . 0.0 114.06 -176.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -60.68 -26.83 67.39 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.646 -1.284 . . . . 0.0 111.348 168.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -71.88 -2.47 18.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.348 1.459 . . . . 0.0 114.274 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 -31.77 24.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.815 1.189 . . . . 0.0 111.678 168.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.78 -28.11 63.4 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.889 1.276 . . . . 0.0 111.87 -171.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -69.98 -30.19 67.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.75 1.22 . . . . 0.0 114.008 171.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -167.954 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.471 0.623 0 CA-C-O 117.829 -1.081 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 61.1 m 107.51 84.06 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 129.857 3.263 . . . . 0.0 115.761 167.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.29 69.16 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.243 -1.536 . . . . 0.0 111.751 175.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.453 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 8.3 ptpt -77.7 3.03 15.02 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 175.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -125.9 7.97 7.42 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.942 1.297 . . . . 0.0 112.194 169.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 34.5 ttm -62.71 125.04 22.6 Favored 'General case' 0 C--N 1.346 0.457 0 O-C-N 121.048 -1.032 . . . . 0.0 109.597 176.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.4 t -77.63 153.15 33.44 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.81 -0.556 . . . . 0.0 110.1 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.05 -30.62 71.68 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 120.475 -1.391 . . . . 0.0 112.978 -173.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -64.67 -31.67 73.0 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.857 0.753 . . . . 0.0 112.847 170.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -78.53 -38.39 40.65 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.854 1.261 . . . . 0.0 111.414 174.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -59.7 -48.15 82.83 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 121.541 -0.724 . . . . 0.0 112.728 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.57 -2.28 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.961 0.904 . . . . 0.0 113.116 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -109.31 -12.68 14.73 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.282 1.833 . . . . 0.0 114.112 173.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 157.78 35.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.944 1.247 . . . . 0.0 111.032 172.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.403 HD21 ' HD2' ' B' ' 98' ' ' LYS . 51.9 t-20 -66.59 130.21 94.1 Favored Pre-proline 0 N--CA 1.483 1.178 0 O-C-N 121.462 -0.774 . . . . 0.0 111.614 -175.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.82 -18.3 33.75 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.562 2.841 . . . . 0.0 115.188 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 98' ' ' LYS . . . . . 0.403 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.8 mttt -58.5 -68.69 0.23 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.07 1.748 . . . . 0.0 109.512 167.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.31 -2.49 49.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -177.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.9 ttm -61.92 -36.99 82.98 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 120.71 -1.243 . . . . 0.0 111.811 168.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 49.8 m -63.88 -52.26 58.38 Favored Pre-proline 0 N--CA 1.483 1.202 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.827 -177.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 102' ' ' PRO . . . . . 0.405 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 3.1 Cg_exo -47.8 -49.56 13.4 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 124.303 3.335 . . . . 0.0 114.932 169.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.91 -33.9 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 119.201 0.909 . . . . 0.0 113.205 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -25.13 67.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.807 0.843 . . . . 0.0 112.007 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 70.2 t90 -83.55 -55.85 4.06 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.078 165.122 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.4 t90 -62.62 -34.45 77.05 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 117.534 -1.666 . . . . 0.0 114.108 -162.415 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -64.74 -43.29 93.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.15 0.98 . . . . 0.0 111.601 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.545 0.755 0 C-N-CA 126.209 1.804 . . . . 0.0 111.739 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -57.48 -29.49 64.31 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.615 0.766 . . . . 0.0 112.476 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.9 m -81.21 -36.1 30.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.475 1.11 . . . . 0.0 112.161 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.48 -29.39 28.03 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.88 -41.34 78.48 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 120.163 1.347 . . . . 0.0 113.365 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -74.15 -36.43 3.33 Favored 'Trans proline' 0 C--N 1.354 0.86 0 CA-C-N 122.257 1.842 . . . . 0.0 113.613 169.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -66.81 -30.44 70.63 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.398 -1.439 . . . . 0.0 114.092 -175.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.4 m -69.09 -22.19 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 28.3 mt -79.2 -50.98 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.258 1.023 . . . . 0.0 109.581 170.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -59.05 -38.55 79.64 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.11 -29.98 68.17 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.002 0.819 . . . . 0.0 112.227 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.88 -47.58 44.77 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.168 -0.957 . . . . 0.0 112.505 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -28.27 67.49 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 120.333 1.424 . . . . 0.0 114.472 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -77.29 -24.68 50.93 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.051 1.501 . . . . 0.0 115.051 171.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -135.08 72.79 66.69 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.807 1.243 . . . . 0.0 111.892 172.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.76 -12.16 17.16 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.804 3.003 . . . . 0.0 117.182 -173.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.71 -20.6 39.08 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.6 1.16 . . . . 0.0 113.486 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 52.0 mmtt -65.8 157.55 30.06 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.845 0.858 . . . . 0.0 112.135 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 28.2 t30 -93.07 131.47 38.06 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.2 tp -47.66 -39.02 16.15 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.385 1.474 . . . . 0.0 114.685 -172.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.453 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.4 m-85 -79.72 -8.79 59.45 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 68.4 p -60.46 -26.7 66.97 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 120.596 -1.315 . . . . 0.0 110.976 167.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -73.41 -2.22 21.47 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.18 1.392 . . . . 0.0 113.53 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -81.72 -32.87 31.39 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.688 1.131 . . . . 0.0 111.783 167.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -67.27 -31.12 71.22 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.539 1.136 . . . . 0.0 112.269 -169.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -70.38 -28.05 64.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.592 1.957 . . . . 0.0 115.502 172.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 115.596 1.702 . . . . 0.0 115.596 -166.434 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 N--CA 1.445 -0.699 0 N-CA-C 102.929 -2.989 . . . . 0.0 102.929 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.6 m -94.77 89.58 5.75 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 124.562 1.145 . . . . 0.0 112.345 -163.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.17 65.34 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 120.008 1.277 . . . . 0.0 111.014 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.2 mtmt -62.96 -20.72 65.52 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 127.16 2.184 . . . . 0.0 115.018 175.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -121.67 16.2 11.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.774 1.63 . . . . 0.0 111.778 177.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.3 ttm -61.77 117.73 6.23 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.53 155.04 36.48 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.162 -0.961 . . . . 0.0 109.499 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.18 -32.81 74.3 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.303 -1.498 . . . . 0.0 112.787 -172.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -62.84 -35.2 79.16 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 170.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -75.41 -37.88 60.21 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.826 1.251 . . . . 0.0 111.479 174.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -60.18 -50.69 72.67 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.531 -0.731 . . . . 0.0 112.241 177.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.5 pt -69.52 -1.19 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.547 1.139 . . . . 0.0 112.958 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -110.85 -10.87 14.41 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.728 1.611 . . . . 0.0 113.972 173.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 164.92 22.4 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.962 -1.086 . . . . 0.0 110.255 169.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.77 128.04 93.19 Favored Pre-proline 0 CA--C 1.556 1.196 0 O-C-N 120.84 -1.162 . . . . 0.0 112.219 -176.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -61.3 -7.26 8.06 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.788 3.658 . . . . 0.0 116.24 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 5.9 mptt -71.56 -59.29 2.83 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 127.072 2.149 . . . . 0.0 109.056 165.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.13 0.22 54.09 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 82.1 mtp -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 120.84 -1.162 . . . . 0.0 112.364 169.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.7 m -65.63 -51.18 51.82 Favored Pre-proline 0 N--CA 1.483 1.189 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.05 -45.62 39.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.179 2.586 . . . . 0.0 114.932 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.7 p -71.64 -31.88 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.605 -1.31 . . . . 0.0 113.419 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.1 -24.16 67.59 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.742 0.817 . . . . 0.0 111.485 171.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.439 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 74.0 t90 -85.09 -53.43 5.28 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.263 167.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.424 ' CH2' ' HB3' ' B' ' 105' ' ' TRP . 0.1 OUTLIER -52.94 -34.48 55.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.075 0.94 . . . . 0.0 112.62 -172.679 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -69.62 -49.14 56.69 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.676 1.19 . . . . 0.0 112.259 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 125.79 1.636 . . . . 0.0 111.813 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.29 -24.99 67.85 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.08 0.952 . . . . 0.0 112.211 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.8 m -79.83 -32.19 40.6 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.46 1.104 . . . . 0.0 111.627 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -87.4 -28.7 21.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.577 1.08 . . . . 0.0 113.579 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.39 -41.97 79.27 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.185 173.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.41 -36.51 6.78 Favored 'Trans proline' 0 C--N 1.355 0.91 0 CA-C-N 122.382 1.886 . . . . 0.0 113.357 169.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -65.96 -35.62 81.08 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 120.317 -1.489 . . . . 0.0 113.565 -177.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.23 -21.43 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 174.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.6 mt -82.72 -51.37 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.901 0.88 . . . . 0.0 110.555 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.97 -43.21 73.3 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.043 0.937 . . . . 0.0 111.33 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -67.46 -30.05 69.67 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.918 -0.489 . . . . 0.0 111.732 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.5 m -74.41 -46.03 42.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.182 -0.913 . . . . 0.0 113.174 173.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -30.34 68.49 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.866 1.667 . . . . 0.0 114.453 177.169 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.252 20.4 pttt -79.21 -24.73 42.91 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 175.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -135.29 74.95 60.22 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 125.323 1.449 . . . . 0.0 112.522 169.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -59.53 -11.3 13.57 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.523 3.482 . . . . 0.0 117.176 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -80.15 -21.99 42.52 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.063 1.345 . . . . 0.0 113.369 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -69.43 159.22 33.63 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.861 1.264 . . . . 0.0 111.64 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.38 148.16 30.73 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.625 -0.672 . . . . 0.0 109.991 170.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.35 -33.55 75.76 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.27 -0.894 . . . . 0.0 112.666 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.422 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.7 m-85 -89.96 -24.66 21.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 117.007 2.225 . . . . 0.0 117.007 -169.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.8 t -60.0 -21.99 61.99 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.057 -1.027 . . . . 0.0 111.902 171.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -60.52 -7.44 2.14 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.944 -1.723 . . . . 0.0 113.709 171.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.7 tptt -66.9 -37.51 84.51 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.522 1.529 . . . . 0.0 112.258 167.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -29.88 71.03 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -167.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -85.29 -23.16 28.26 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.581 1.952 . . . . 0.0 115.848 -175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 118.501 2.778 . . . . 0.0 118.501 -163.099 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.454 ' HB3' ' HE3' ' A' ' 19' ' ' LYS 0.25 52.9 mm-40 . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 72.7 m 108.0 84.47 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 130.595 3.558 . . . . 0.0 112.334 171.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.84 67.94 Favored 'General case' 0 CA--C 1.556 1.205 0 O-C-N 120.843 -1.161 . . . . 0.0 111.219 173.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.461 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 11.9 mtmt -63.42 -16.72 61.38 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 127.232 2.213 . . . . 0.0 116.601 173.118 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -121.2 9.32 10.43 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.866 1.266 . . . . 0.0 112.603 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.4 ttm -60.93 124.1 19.5 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.391 -0.818 . . . . 0.0 109.42 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -77.46 156.04 31.34 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.634 -0.667 . . . . 0.0 110.907 -177.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.41 -32.83 74.61 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.133 -1.604 . . . . 0.0 113.112 -173.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.78 -29.03 69.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.032 0.833 . . . . 0.0 112.611 171.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -84.25 -36.33 22.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.756 1.622 . . . . 0.0 111.313 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -62.26 -48.95 77.66 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.381 -0.824 . . . . 0.0 112.789 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.69 -6.3 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.816 0.847 . . . . 0.0 112.874 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.91 -11.57 15.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.314 1.846 . . . . 0.0 114.535 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.88 158.4 35.61 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.906 1.23 . . . . 0.0 110.845 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 96' ' ' ASN . . . . . 0.445 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 50.3 t-20 -66.38 131.03 94.22 Favored Pre-proline 0 N--CA 1.481 1.085 0 O-C-N 121.335 -0.853 . . . . 0.0 111.622 -176.212 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 97' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 35.4 Cg_exo -60.9 -18.68 58.46 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.125 2.55 . . . . 0.0 114.566 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -55.34 -67.82 0.25 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.183 1.393 . . . . 0.0 109.85 168.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.02 -4.58 57.07 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 31.4 ttm -59.88 -41.04 90.69 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.04 -1.038 . . . . 0.0 112.032 168.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 67.5 m -56.04 -54.9 47.32 Favored Pre-proline 0 N--CA 1.484 1.229 0 CA-C-O 117.97 -1.014 . . . . 0.0 113.45 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.74 -53.82 5.04 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.02 3.147 . . . . 0.0 113.699 171.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.6 -31.91 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 119.448 -2.032 . . . . 0.0 113.306 -176.054 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.96 73.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.186 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 105' ' ' TRP . . . . . 0.424 ' HB3' ' CH2' ' A' ' 27' ' ' TRP 0.288 0.0 OUTLIER -86.37 -39.23 16.63 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 116.487 -1.72 . . . . 0.0 112.322 176.261 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' B' B ' 106' ' ' TRP . . . . . 0.439 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.4 m0 -62.26 -22.13 65.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 122.419 2.372 . . . . 0.0 113.022 173.36 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -77.47 -57.84 3.6 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.981 0.912 . . . . 0.0 111.873 168.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 CA--C 1.546 0.81 0 C-N-CA 123.671 0.788 . . . . 0.0 112.271 -172.599 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 . . . . . 0 N--CA 1.467 0.389 0 N-CA-C 110.572 -0.159 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 91.6 mt -57.14 -28.21 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.028 0.931 . . . . 0.0 112.389 173.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.5 m -80.8 -36.11 32.17 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.921 0.888 . . . . 0.0 112.013 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -81.95 -31.4 31.26 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.758 1.163 . . . . 0.0 114.058 -177.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.02 -39.68 72.62 Favored Pre-proline 0 CA--C 1.552 1.039 0 CA-C-N 120.07 1.305 . . . . 0.0 113.163 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -75.15 -36.37 2.51 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 122.388 1.889 . . . . 0.0 113.366 169.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -66.06 -29.74 70.14 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.395 -1.441 . . . . 0.0 113.908 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 32.3 m -69.38 -21.75 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 122.968 0.507 . . . . 0.0 112.327 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 10.3 mt -77.68 -50.7 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.327 1.051 . . . . 0.0 109.697 169.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.42 -39.57 87.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.293 0.637 . . . . 0.0 112.516 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.46 -27.46 65.24 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.019 0.827 . . . . 0.0 112.209 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.11 -50.11 20.93 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.453 -0.779 . . . . 0.0 112.319 175.608 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -27.32 68.4 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -79.05 -20.18 49.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 171.116 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -136.44 66.71 58.93 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.472 1.509 . . . . 0.0 110.52 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.23 -14.26 37.17 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 124.142 3.228 . . . . 0.0 116.494 -168.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.95 -24.72 48.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -62.62 157.96 19.42 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.937 1.295 . . . . 0.0 112.302 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -82.17 150.65 27.29 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.552 -0.717 . . . . 0.0 109.988 171.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.72 -41.18 99.04 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.293 -0.879 . . . . 0.0 113.15 176.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 146' ' ' TYR . . . . . 0.461 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.7 m-85 -82.41 -19.72 38.5 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -169.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 11.6 t -64.04 -15.01 58.5 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.793 -1.192 . . . . 0.0 112.197 169.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -67.87 -2.56 7.56 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 119.313 -2.117 . . . . 0.0 113.532 169.115 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -77.71 -30.81 51.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.69 1.132 . . . . 0.0 111.92 165.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -63.52 -33.38 75.45 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.919 1.288 . . . . 0.0 112.177 -169.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.94 -29.06 64.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.618 1.967 . . . . 0.0 115.346 170.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 125.408 1.483 . . . . 0.0 113.025 -168.412 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.25 51.7 t30 57.83 46.13 17.42 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.091 1.756 . . . . 0.0 114.918 176.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -62.74 -20.75 65.24 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.973 167.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.2 t 97.07 93.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 128.885 2.874 . . . . 0.0 117.422 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.53 -33.64 70.09 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 119.921 -1.737 . . . . 0.0 112.345 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 1.1 ptpt -73.85 -9.87 59.08 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 176.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -113.9 5.06 16.07 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.92 1.288 . . . . 0.0 112.468 168.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 29.0 ttm -60.57 127.31 31.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.957 1.253 . . . . 0.0 109.482 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -78.99 155.89 28.68 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.33 -35.75 78.26 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 120.338 -1.476 . . . . 0.0 112.801 -175.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -61.69 -32.47 72.67 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.668 0.787 . . . . 0.0 113.014 172.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -80.57 -36.84 32.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.115 1.366 . . . . 0.0 111.56 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.11 -48.57 81.13 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.532 -0.73 . . . . 0.0 112.327 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.2 pt -70.41 -2.04 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 124.318 1.047 . . . . 0.0 112.809 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -113.46 -15.08 12.66 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.973 1.709 . . . . 0.0 114.281 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 161.81 20.5 Favored 'General case' 0 CA--C 1.558 1.251 0 O-C-N 120.981 -1.074 . . . . 0.0 110.498 169.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.447 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 43.3 t-20 -63.92 132.53 95.28 Favored Pre-proline 0 N--CA 1.483 1.189 0 O-C-N 120.894 -1.129 . . . . 0.0 112.011 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 25.2 Cg_exo -62.22 -16.94 54.15 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.332 2.688 . . . . 0.0 114.831 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mptt -57.87 -62.81 1.54 Allowed 'General case' 0 C--N 1.351 0.657 0 C-N-CA 125.218 1.407 . . . . 0.0 108.829 167.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -77.56 -10.48 59.52 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 89.0 mtp -60.21 -37.68 81.02 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 120.905 -1.122 . . . . 0.0 112.937 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.4 m -61.22 -52.09 73.68 Favored Pre-proline 0 N--CA 1.485 1.295 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.444 ' HB3' ' CG ' ' B' ' 106' ' ' TRP . 38.2 Cg_endo -59.7 -41.79 52.34 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.772 2.315 . . . . 0.0 113.285 169.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 20' ' ' ALA . 87.9 t -56.73 -42.18 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 120.904 -1.123 . . . . 0.0 111.725 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.17 82.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.821 0.848 . . . . 0.0 111.556 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.436 ' HB3' ' CH2' ' B' ' 106' ' ' TRP . 0.0 OUTLIER -76.14 -36.69 58.68 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.882 1.219 . . . . 0.0 111.351 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.495 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -52.13 -41.95 62.95 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.976 1.262 . . . . 0.0 112.254 176.111 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -72.98 -53.31 11.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.795 1.638 . . . . 0.0 111.805 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -66.88 -30.36 70.5 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.49 0.716 . . . . 0.0 112.237 -169.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -103.91 9.07 36.9 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.473 172.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 40.39 57.26 2.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 128.064 2.546 . . . . 0.0 114.799 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 52.58 17.91 0.89 Allowed 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 174.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.9 t -55.75 153.82 7.74 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -170.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.18 -9.0 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.124 1.37 . . . . 0.0 113.528 170.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 71.6 120.34 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.318 2.247 . . . . 0.0 114.687 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -118.52 157.67 26.85 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.639 1.576 . . . . 0.0 112.266 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.62 -11.89 12.37 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 125.106 1.336 . . . . 0.0 115.291 -177.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 169.18 -161.46 35.06 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.738 2.113 . . . . 0.0 111.064 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -125.65 20.51 7.85 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.127 1.371 . . . . 0.0 113.911 178.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 m -75.95 58.4 1.16 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.502 1.921 . . . . 0.0 111.175 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.5 m -67.0 2.06 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 126.679 1.992 . . . . 0.0 114.452 -177.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.64 151.19 11.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.26 1.824 . . . . 0.0 112.21 172.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.9 mt -63.98 121.28 13.73 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.823 -0.548 . . . . 0.0 110.985 170.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -86.37 162.43 18.18 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.799 1.64 . . . . 0.0 109.943 174.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.81 -29.32 69.22 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.138 -1.601 . . . . 0.0 112.939 -175.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.0 m -60.26 -47.8 84.46 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.64 -49.24 78.3 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.499 0.719 . . . . 0.0 109.549 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.23 -34.6 72.4 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.563 1.145 . . . . 0.0 111.904 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 98.4 m -71.98 -36.2 69.74 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.762 0.825 . . . . 0.0 111.189 174.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -79.49 -24.86 42.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.519 -178.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.77 -46.1 98.53 Favored Pre-proline 0 N--CA 1.481 1.092 0 CA-C-N 120.824 1.647 . . . . 0.0 112.535 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.25 -37.6 10.16 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.808 1.672 . . . . 0.0 113.3 170.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -66.08 -34.9 79.12 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.704 -1.247 . . . . 0.0 113.391 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.6 m -68.96 -17.17 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 118.965 0.802 . . . . 0.0 113.16 175.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -88.42 -52.44 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.369 1.068 . . . . 0.0 110.367 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -55.7 -47.82 76.17 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.292 1.037 . . . . 0.0 110.621 177.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -63.54 -25.24 68.16 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.43 -0.794 . . . . 0.0 112.106 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.17 -49.03 13.21 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.484 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.01 68.62 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 120.961 1.71 . . . . 0.0 113.966 174.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -71.22 -28.32 64.11 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 114.392 169.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.4 m-80 -135.37 66.57 65.89 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.982 1.313 . . . . 0.0 112.383 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -57.59 -15.68 21.28 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.591 2.861 . . . . 0.0 116.575 -173.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -82.6 -21.3 35.22 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.298 1.439 . . . . 0.0 113.523 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -71.62 160.37 32.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.694 1.197 . . . . 0.0 111.933 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -76.56 154.7 34.26 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.854 -0.529 . . . . 0.0 109.891 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -70.18 -38.42 75.37 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.264 -0.898 . . . . 0.0 113.103 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 1.4 m-85 -82.58 -21.96 35.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.0 t -60.11 -20.76 59.86 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.377 -0.827 . . . . 0.0 111.961 173.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -62.03 -5.07 1.93 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.586 -1.946 . . . . 0.0 114.074 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -33.77 74.13 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 119.806 1.184 . . . . 0.0 111.518 165.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -62.13 -31.93 72.46 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -167.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -74.78 -28.01 60.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.774 1.63 . . . . 0.0 115.129 176.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -94.23 128.78 40.89 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -166.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.8 m -90.2 -24.83 20.9 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 52.56 -96.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.611 1.564 . . . . 0.0 114.024 -173.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -168.75 -31.71 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.257 2.223 . . . . 0.0 112.101 -169.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.19 149.76 86.06 Favored Pre-proline 0 CA--C 1.56 1.344 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 -175.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -87.17 153.89 8.2 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.073 3.182 . . . . 0.0 113.554 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 116.999 -1.477 . . . . 0.0 112.735 168.774 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.436 0.16 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.25 13.8 t-20 68.02 66.65 0.35 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 124.612 2.149 . . . . 0.0 112.527 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -117.47 154.09 32.0 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 129.807 3.243 . . . . 0.0 103.69 167.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m -87.57 87.91 7.52 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 125.298 1.439 . . . . 0.0 113.285 -165.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.88 -38.57 56.59 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 120.383 1.447 . . . . 0.0 110.463 170.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -67.8 -7.03 24.28 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 127.686 2.394 . . . . 0.0 115.707 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -136.59 18.85 3.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.91 1.284 . . . . 0.0 112.482 174.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.9 ttm -59.48 120.92 10.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 168.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.0 t -73.77 153.79 39.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.107 -0.995 . . . . 0.0 109.552 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.71 -31.24 72.11 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.55 -1.344 . . . . 0.0 113.235 -172.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -65.84 -32.43 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.198 0.908 . . . . 0.0 113.121 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -76.5 -36.6 57.69 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.292 1.437 . . . . 0.0 111.115 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -63.79 -48.64 76.07 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.29 -0.881 . . . . 0.0 112.932 177.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.0 pt -69.63 -5.16 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 123.345 0.658 . . . . 0.0 112.697 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -103.47 -15.46 15.87 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.221 1.808 . . . . 0.0 114.23 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 158.86 31.72 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.9 1.227 . . . . 0.0 110.581 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.408 HD21 ' HD2' ' B' ' 98' ' ' LYS . 49.7 t-20 -66.4 132.05 94.29 Favored Pre-proline 0 N--CA 1.481 1.092 0 O-C-N 121.416 -0.802 . . . . 0.0 111.6 -174.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -56.95 -20.46 36.69 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.81 3.007 . . . . 0.0 115.379 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 96' ' ' ASN . 32.1 mttt -56.7 -64.12 0.98 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.996 1.719 . . . . 0.0 108.89 166.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.34 -12.15 59.1 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.0 ttm -57.02 -35.87 69.77 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.511 -1.368 . . . . 0.0 111.916 172.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.4 m -63.0 -54.92 42.25 Favored Pre-proline 0 N--CA 1.482 1.155 0 C-N-CA 124.319 1.047 . . . . 0.0 112.81 -177.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' PRO . . . . . 0.419 ' HG2' HG22 ' A' ' 24' ' ' VAL . 1.5 Cg_endo -50.1 -45.94 30.74 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.5 2.8 . . . . 0.0 113.685 168.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.64 -38.51 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.003 0.82 . . . . 0.0 111.838 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.63 90.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.576 0.751 . . . . 0.0 111.297 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CG ' ' CH2' ' A' ' 27' ' ' TRP . 89.5 t90 -67.35 -46.79 72.35 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.59 1.086 . . . . 0.0 110.243 167.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.444 ' CG ' ' HB3' ' A' ' 23' ' ' PRO . 0.6 OUTLIER -58.34 -33.28 69.36 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 123.427 1.584 . . . . 0.0 113.073 -168.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.3 tmm? -76.05 -42.59 47.11 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.234 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' LEU . . . . . 0.415 HD21 HG11 ' B' ' 133' ' ' VAL . 3.4 mm? -64.91 -22.82 67.06 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.849 -1.157 . . . . 0.0 114.063 171.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 -141.56 95.87 2.89 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.927 2.091 . . . . 0.0 109.267 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.25 169.34 1.65 Allowed 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 -174.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.1 2.14 0.38 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 174.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.3 t -62.91 177.72 0.54 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.728 1.211 . . . . 0.0 112.474 169.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -109.58 153.53 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.498 1.519 . . . . 0.0 110.506 -178.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.33 168.49 18.96 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -169.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 26.8 mtmt -121.26 54.46 1.11 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.47 1.508 . . . . 0.0 113.538 -167.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.06 31.33 26.2 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.431 1.015 . . . . 0.0 115.063 169.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -156.76 -171.26 22.7 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.121 0.867 . . . . 0.0 114.473 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -126.55 10.92 7.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.964 1.306 . . . . 0.0 114.52 -173.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 33.5 p -72.69 13.8 0.33 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.93 -15.94 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.552 1.541 . . . . 0.0 113.494 171.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.43 161.75 1.82 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.791 1.236 . . . . 0.0 112.848 169.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 75.5 mt -74.38 71.31 1.76 Allowed 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 122.321 1.058 . . . . 0.0 108.616 166.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -64.71 166.85 8.18 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.342 2.257 . . . . 0.0 110.998 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.91 -26.28 65.91 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.486 -1.384 . . . . 0.0 113.998 -170.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.0 m -66.94 -47.89 70.25 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.313 -0.867 . . . . 0.0 110.476 169.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.84 -47.23 86.58 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.486 -0.759 . . . . 0.0 111.943 174.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.57 -30.06 64.94 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.183 -0.948 . . . . 0.0 112.706 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 68.0 m -80.39 -34.47 36.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.952 0.901 . . . . 0.0 111.949 174.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -79.63 -36.84 37.28 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 117.869 -1.062 . . . . 0.0 113.527 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -48.96 -46.3 74.68 Favored Pre-proline 0 N--CA 1.478 0.929 0 CA-C-N 120.238 1.381 . . . . 0.0 113.017 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.6 -38.21 6.24 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 CA-C-N 122.074 1.777 . . . . 0.0 113.448 171.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -64.81 -34.4 78.27 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.913 1.233 . . . . 0.0 113.367 -175.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' VAL . . . . . 0.415 HG11 HD21 ' B' ' 108' ' ' LEU . 20.8 m -75.48 -27.86 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.217 0.607 . . . . 0.0 112.575 177.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.9 mt -67.8 -47.24 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.09 -38.82 80.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.887 0.875 . . . . 0.0 112.316 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.49 -31.88 73.19 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.181 0.901 . . . . 0.0 112.149 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -72.14 -48.01 46.77 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.802 -1.186 . . . . 0.0 112.397 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -29.4 68.54 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.181 1.355 . . . . 0.0 114.502 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -79.32 -22.08 45.04 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 171.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.47 64.89 66.12 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 126.66 1.984 . . . . 0.0 110.45 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -64.22 -11.49 28.11 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.988 3.125 . . . . 0.0 115.881 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -81.42 -21.26 39.02 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.705 1.202 . . . . 0.0 113.387 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -68.03 159.03 31.6 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.838 0.855 . . . . 0.0 112.373 -173.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -83.9 127.91 34.18 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.7 tp -44.73 -38.86 4.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.03 -7.59 58.23 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 57.4 p -60.43 -30.15 69.45 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 120.579 -1.325 . . . . 0.0 111.125 167.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -69.54 -2.45 11.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.774 1.63 . . . . 0.0 113.533 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -38.38 53.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.159 0.983 . . . . 0.0 110.896 166.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -29.97 71.02 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -167.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -68.68 -27.78 66.28 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.661 1.984 . . . . 0.0 115.646 170.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -104.46 105.38 15.47 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.11 1.364 . . . . 0.0 114.214 -167.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 19.7 m -84.97 30.77 0.57 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.007 1.323 . . . . 0.0 114.253 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -83.55 -17.89 40.23 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -169.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -84.88 44.44 1.07 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -170.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -155.9 158.78 31.81 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.725 1.61 . . . . 0.0 111.596 172.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -65.78 155.0 71.46 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.715 2.277 . . . . 0.0 112.667 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.665 1.586 . . . . 0.0 112.85 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.312 10.4 t-20 68.31 35.34 3.48 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -73.89 161.32 30.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 126.87 2.068 . . . . 0.0 106.847 163.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.0 t -102.75 92.93 4.82 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.895 1.278 . . . . 0.0 113.065 -165.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.58 68.45 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.418 -1.426 . . . . 0.0 111.329 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 5.6 ptpt -74.41 -7.22 52.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.241 1.816 . . . . 0.0 115.228 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -123.41 15.81 9.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.404 1.482 . . . . 0.0 111.95 168.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.1 ttm -61.86 118.63 7.46 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.829 -1.169 . . . . 0.0 108.446 171.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -76.64 155.35 33.51 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.059 -1.026 . . . . 0.0 109.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.84 -29.72 69.71 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 120.312 -1.492 . . . . 0.0 113.784 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -40.74 96.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.114 0.87 . . . . 0.0 111.804 169.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -66.86 -37.02 83.65 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.772 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -60.91 -52.99 62.68 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.39 -0.819 . . . . 0.0 112.299 177.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.04 -0.93 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.103 1.361 . . . . 0.0 112.785 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -107.16 -15.59 14.63 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.427 1.491 . . . . 0.0 113.61 172.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.38 164.56 22.67 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.076 -1.015 . . . . 0.0 110.522 169.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.487 HD21 ' HD3' ' A' ' 19' ' ' LYS . 52.7 t-20 -71.73 131.37 86.05 Favored Pre-proline 0 N--CA 1.484 1.233 0 O-C-N 120.867 -1.145 . . . . 0.0 112.411 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -18.37 23.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.557 3.505 . . . . 0.0 116.299 175.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.487 ' HD3' HD21 ' A' ' 17' ' ' ASN . 10.9 mttt -60.36 -58.19 9.55 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.304 1.842 . . . . 0.0 109.212 167.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.46 -2.68 58.78 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 75.4 mtp -63.18 -36.65 84.33 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.43 -1.419 . . . . 0.0 111.509 169.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.7 m -59.81 -52.25 75.08 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 124.776 1.231 . . . . 0.0 113.362 -177.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -53.19 -58.58 1.38 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.165 2.576 . . . . 0.0 113.94 167.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.4 p -63.48 -25.26 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 120.893 1.679 . . . . 0.0 113.294 -169.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.37 67.94 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 118.124 -0.941 . . . . 0.0 113.21 171.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 62.6 t90 -84.03 -55.34 4.27 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.176 1.353 . . . . 0.0 114.303 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.451 ' CD1' ' HB3' ' B' ' 102' ' ' PRO . 4.7 m95 -51.68 -40.28 59.79 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.886 0.85 . . . . 0.0 110.888 -173.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -58.57 -49.38 77.65 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.941 1.697 . . . . 0.0 111.934 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.77 -19.81 64.37 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.976 1.311 . . . . 0.0 113.755 175.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -101.81 -1.4 32.37 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 173.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 65.57 163.57 0.16 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.193 2.197 . . . . 0.0 115.751 178.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -75.59 78.51 2.59 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.742 -1.224 . . . . 0.0 110.251 170.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -148.39 174.11 12.39 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.143 1.777 . . . . 0.0 111.105 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.4 p -114.75 147.53 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.121 1.369 . . . . 0.0 109.351 169.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.07 151.84 45.94 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.76 53.7 1.89 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.577 1.551 . . . . 0.0 113.606 -167.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.67 -10.25 62.59 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 125.733 1.635 . . . . 0.0 115.921 172.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.78 170.88 46.36 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.678 1.239 . . . . 0.0 113.601 172.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -121.53 9.28 10.22 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.524 1.53 . . . . 0.0 113.084 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.6 p -74.29 17.77 0.18 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.299 1.84 . . . . 0.0 114.91 -173.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 m -62.78 -24.56 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.93 169.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.456 HG23 HG23 ' B' ' 113' ' ' VAL . 0.1 OUTLIER -57.97 152.73 15.71 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.78 0.832 . . . . 0.0 111.848 170.824 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -76.36 79.55 3.11 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 123.062 1.41 . . . . 0.0 110.894 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -63.57 166.75 6.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.645 2.378 . . . . 0.0 110.571 168.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.05 -22.37 64.95 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.535 -1.353 . . . . 0.0 113.998 -171.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 53.8 m -66.73 -47.88 70.93 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.112 0.869 . . . . 0.0 110.45 170.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.16 -45.88 89.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.554 173.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.47 -28.38 69.17 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.179 -0.951 . . . . 0.0 112.127 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 96.8 m -74.47 -38.41 62.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.39 0.676 . . . . 0.0 111.06 172.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -83.17 -32.21 26.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.121 -1.419 . . . . 0.0 114.033 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -46.64 -48.62 48.64 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-N 120.626 1.557 . . . . 0.0 112.77 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -36.3 30.01 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.376 2.051 . . . . 0.0 113.949 172.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -64.11 -34.19 77.47 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.833 -1.167 . . . . 0.0 112.977 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.09 -30.4 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.61 0.641 . . . . 0.0 111.692 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 mt -78.62 -51.17 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.506 0.722 . . . . 0.0 110.585 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.49 -39.3 87.2 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.646 0.778 . . . . 0.0 112.075 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -68.73 -31.05 69.84 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.305 0.642 . . . . 0.0 111.293 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.4 m -73.43 -46.04 50.86 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.086 -1.009 . . . . 0.0 113.223 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.42 68.77 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 121.032 1.742 . . . . 0.0 114.235 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -76.88 -33.79 57.81 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 174.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -132.4 77.56 69.96 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.631 1.172 . . . . 0.0 112.019 172.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -54.13 -11.78 3.07 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 124.972 3.781 . . . . 0.0 117.255 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -27.23 56.75 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.22 1.408 . . . . 0.0 112.527 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt -65.97 157.51 30.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.798 1.239 . . . . 0.0 112.493 -174.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -93.05 133.89 35.74 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 169.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.6 tp -49.81 -32.87 15.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.448 1.499 . . . . 0.0 114.175 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.1 m-85 -82.8 -10.76 58.72 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.2 p -60.61 -25.79 66.53 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.698 -1.252 . . . . 0.0 111.573 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -72.73 -0.08 12.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.723 1.609 . . . . 0.0 113.944 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.36 -34.18 25.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.649 1.579 . . . . 0.0 111.48 167.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -70.18 -28.8 65.6 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.045 1.338 . . . . 0.0 111.933 -170.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -71.88 -30.28 65.24 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.49 1.516 . . . . 0.0 115.008 175.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -102.88 -35.14 8.71 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -166.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.0 m 62.62 -41.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 127.523 2.329 . . . . 0.0 115.662 -169.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 22.6 t30 66.96 167.0 0.23 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 129.648 3.179 . . . . 0.0 116.318 175.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -72.34 22.39 0.06 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 128.115 2.566 . . . . 0.0 116.945 -167.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.51 151.71 65.78 Favored Pre-proline 0 CA--C 1.55 0.945 0 O-C-N 120.703 -1.248 . . . . 0.0 112.389 172.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.2 161.73 44.89 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.894 2.396 . . . . 0.0 112.104 170.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.254 1.34 0 C-N-CA 125.451 1.501 . . . . 0.0 112.133 -176.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 49.8 t30 56.86 48.9 15.1 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.793 1.637 . . . . 0.0 113.927 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -62.55 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.084 0.954 . . . . 0.0 113.144 169.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 97.63 99.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.891 2.876 . . . . 0.0 116.156 168.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.33 -30.9 67.06 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 120.083 -1.636 . . . . 0.0 111.774 169.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -67.08 -17.85 65.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.085 1.754 . . . . 0.0 115.292 174.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.57 6.29 14.57 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.596 1.158 . . . . 0.0 113.175 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.3 ttm -63.21 125.71 24.99 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.96 -1.087 . . . . 0.0 110.651 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -79.87 155.48 27.78 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.834 -1.166 . . . . 0.0 110.866 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.08 -35.36 78.43 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.116 -1.615 . . . . 0.0 112.862 -174.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.31 -29.42 70.5 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.182 0.901 . . . . 0.0 112.731 173.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -82.45 -35.58 27.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.719 1.608 . . . . 0.0 111.386 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -63.35 -48.55 77.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.789 0.835 . . . . 0.0 112.727 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -67.75 -4.52 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.785 0.834 . . . . 0.0 112.854 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.28 -11.03 15.66 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.487 1.915 . . . . 0.0 114.404 172.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 158.26 36.01 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.653 -1.279 . . . . 0.0 110.83 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -65.41 129.98 94.55 Favored Pre-proline 0 N--CA 1.478 0.941 0 O-C-N 121.207 -0.933 . . . . 0.0 111.534 -178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.75 -18.08 53.78 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.935 2.423 . . . . 0.0 114.808 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -54.5 -66.95 0.31 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.217 1.407 . . . . 0.0 109.521 168.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.55 -9.84 59.69 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.8 ttm -56.26 -43.44 78.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.871 0.868 . . . . 0.0 112.581 171.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 86.6 m -55.85 -54.73 48.75 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.019 -0.991 . . . . 0.0 113.655 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 7.4 Cg_endo -54.4 -54.2 5.01 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 124.438 3.425 . . . . 0.0 114.073 169.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.13 -31.39 52.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 119.667 -1.896 . . . . 0.0 113.338 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.27 71.16 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.399 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.407 ' HB3' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -86.83 -41.1 14.32 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 116.402 -1.761 . . . . 0.0 111.593 175.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.421 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 6.2 m0 -59.74 -22.95 62.77 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 123.356 2.798 . . . . 0.0 113.659 171.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.9 tmm? -76.97 -63.99 1.23 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.43 0.692 . . . . 0.0 111.092 167.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.93 -32.82 74.53 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.639 1.176 . . . . 0.0 113.842 -168.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -116.71 -0.32 12.38 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.516 1.526 . . . . 0.0 112.982 -172.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 57.95 -1.3 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 118.579 2.807 . . . . 0.0 118.579 169.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 62.42 -67.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.485 1.914 . . . . 0.0 113.581 -171.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . 0.252 10.8 t 38.15 46.18 0.83 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.311 2.244 . . . . 0.0 113.96 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 113' ' ' VAL . . . . . 0.456 HG23 HG23 ' A' ' 42' ' ' THR . 2.6 p 52.74 -1.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 129.701 3.201 . . . . 0.0 117.497 -178.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . 0.291 0.5 OUTLIER 58.69 43.3 18.98 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 127.308 2.243 . . . . 0.0 113.817 -170.77 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 46.6 pttt -38.6 123.91 1.27 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.86 2.064 . . . . 0.0 113.196 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 69.93 6.06 54.82 Favored Glycine 0 CA--C 1.54 1.616 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 171.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -146.69 -173.46 17.93 Favored Glycine 0 CA--C 1.536 1.352 0 CA-C-N 120.088 1.944 . . . . 0.0 114.942 -177.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -136.79 -4.69 1.98 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 22.6 p -77.34 43.6 0.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.431 1.893 . . . . 0.0 114.781 -173.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 36.0 m -64.19 -16.94 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 125.27 1.428 . . . . 0.0 113.21 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.16 159.21 4.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.423 1.489 . . . . 0.0 111.684 168.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.22 106.14 3.21 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.051 -1.031 . . . . 0.0 109.433 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -76.35 164.99 25.48 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.323 1.049 . . . . 0.0 109.464 173.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -64.26 -26.1 68.35 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.221 -1.549 . . . . 0.0 112.2 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 11.2 m -63.89 -44.06 94.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.957 169.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -62.72 -49.84 73.47 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.21 0.913 . . . . 0.0 111.003 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 92.0 mt -57.28 -28.35 62.92 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.523 0.729 . . . . 0.0 112.48 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 53.3 m -83.94 -34.69 24.41 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.607 1.163 . . . . 0.0 112.406 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -84.67 -33.34 23.23 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 117.608 -1.187 . . . . 0.0 113.751 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.33 -43.86 92.15 Favored Pre-proline 0 N--CA 1.481 1.11 0 CA-C-N 120.457 1.48 . . . . 0.0 112.871 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.46 -39.07 7.55 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 CA-C-N 122.389 1.889 . . . . 0.0 113.312 171.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.24 -33.91 77.1 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.776 1.171 . . . . 0.0 113.76 -174.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.32 -24.07 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.358 0.663 . . . . 0.0 112.355 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 27.5 mt -73.95 -49.78 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.607 0.763 . . . . 0.0 109.567 170.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -58.51 -41.56 85.7 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.957 0.903 . . . . 0.0 112.258 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.79 -26.16 65.96 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.167 -0.958 . . . . 0.0 112.302 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.2 -47.15 25.09 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.766 0.827 . . . . 0.0 112.215 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -26.86 68.14 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 120.268 1.394 . . . . 0.0 114.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.258 15.1 ptpt -84.13 -10.15 58.01 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -137.56 61.35 30.42 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 111.112 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.65 -14.16 34.19 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.877 3.051 . . . . 0.0 115.679 -168.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -85.57 -14.99 44.07 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 113.657 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -74.43 158.5 33.76 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.199 0.999 . . . . 0.0 111.765 -172.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -92.86 133.7 35.81 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.23 -40.05 46.42 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.914 1.285 . . . . 0.0 114.272 -169.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.257 5.0 m-85 -79.2 -6.84 57.53 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.9 p -61.97 -27.12 68.63 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.694 -1.254 . . . . 0.0 111.176 168.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -72.58 -3.66 26.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.04 1.336 . . . . 0.0 113.943 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -81.38 -29.46 34.01 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.374 0.988 . . . . 0.0 112.036 167.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -68.97 -32.12 71.47 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.747 0.819 . . . . 0.0 112.049 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -69.67 -28.43 65.86 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.16 1.784 . . . . 0.0 115.376 169.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -108.09 106.48 16.72 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -165.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 22.9 t -91.87 96.85 10.62 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 167.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -84.04 -167.31 1.7 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.369 1.067 . . . . 0.0 112.563 -171.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.95 -13.2 44.18 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.41 146.71 97.85 Favored Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 124.908 1.283 . . . . 0.0 114.435 -175.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -65.84 160.46 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.178 2.585 . . . . 0.0 113.328 169.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.501 1.12 . . . . 0.0 113.569 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 119.969 -0.062 . . . . 0.0 111.084 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -165.94 113.07 0.91 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.622 1.201 . . . . 0.0 108.611 167.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -166.28 -166.07 0.85 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.341 2.657 . . . . 0.0 106.439 -168.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.517 ' H ' ' HG2' ' B' ' 98' ' ' LYS . 15.0 m -134.48 56.76 1.83 Allowed 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 123.675 0.79 . . . . 0.0 110.248 169.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -52.76 -40.97 63.6 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 121.273 1.851 . . . . 0.0 111.475 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 3.3 ptpt -64.53 -11.04 30.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.511 2.324 . . . . 0.0 116.172 175.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -133.28 21.0 4.02 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.036 1.735 . . . . 0.0 111.727 171.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.477 ' HE1' ' HB2' ' B' ' 99' ' ' ALA . 19.3 ttm -62.13 122.65 16.08 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.6 t -76.96 153.97 34.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.08 -32.61 74.03 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 120.616 -1.302 . . . . 0.0 112.823 -173.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -62.96 -31.13 72.17 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.712 0.805 . . . . 0.0 112.971 170.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.73 -39.41 27.04 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.41 1.484 . . . . 0.0 111.851 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -58.71 -49.76 76.42 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.476 -0.765 . . . . 0.0 113.028 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -67.25 -4.44 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 C-N-CA 123.979 0.912 . . . . 0.0 112.668 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -112.94 -5.48 13.81 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.227 1.811 . . . . 0.0 113.813 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.424 HD22 ' HE1' ' A' ' 8' ' ' MET . 0.3 OUTLIER -75.81 161.98 28.55 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.897 -1.127 . . . . 0.0 110.382 173.618 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.439 HD21 ' HD3' ' A' ' 19' ' ' LYS . 45.2 t-20 -66.41 128.19 93.71 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 120.899 -1.126 . . . . 0.0 111.611 -174.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.4 -20.81 16.32 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.339 3.359 . . . . 0.0 115.879 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HD3' HD21 ' A' ' 17' ' ' ASN . 5.4 mptt -59.86 -67.07 0.42 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.181 1.792 . . . . 0.0 109.811 168.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.16 -5.29 57.53 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -177.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -60.79 -40.38 92.44 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.1 -1.0 . . . . 0.0 112.674 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.253 23.7 m -65.4 -52.11 47.79 Favored Pre-proline 0 N--CA 1.479 0.993 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -177.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.69 -42.85 42.19 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.558 2.839 . . . . 0.0 116.146 169.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.33 -37.44 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 119.913 1.233 . . . . 0.0 113.087 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.83 -28.62 68.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.781 0.832 . . . . 0.0 111.738 171.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.8 t90 -81.83 -53.77 5.91 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 117.693 -1.146 . . . . 0.0 112.406 170.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.43 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.0 t90 -64.12 -37.81 88.78 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 120.365 1.439 . . . . 0.0 111.281 -167.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -59.08 -31.23 68.71 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.746 1.218 . . . . 0.0 112.615 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.04 -5.1 39.47 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -134.36 -35.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 63.06 168.59 0.14 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.457 1.903 . . . . 0.0 111.599 -165.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.34 35.69 0.15 Allowed 'General case' 0 N--CA 1.481 1.08 0 O-C-N 119.737 -1.852 . . . . 0.0 113.856 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.1 t -76.22 147.98 38.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.414 1.486 . . . . 0.0 112.702 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.8 t -78.9 133.97 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.858 0.863 . . . . 0.0 110.441 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.4 153.97 39.0 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.786 1.634 . . . . 0.0 113.465 -176.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -150.41 157.63 43.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.619 1.568 . . . . 0.0 111.261 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.27 -35.38 0.66 Allowed Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.536 1.541 . . . . 0.0 115.469 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -154.03 -165.59 13.92 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.072 1.796 . . . . 0.0 112.825 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -126.6 20.76 7.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.196 1.798 . . . . 0.0 113.782 -174.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.3 p -76.99 48.79 0.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.315 1.846 . . . . 0.0 114.715 -169.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.97 -14.24 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 O-C-N 121.06 -1.025 . . . . 0.0 112.405 168.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.26 152.21 8.59 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.979 2.111 . . . . 0.0 112.08 168.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -75.85 81.42 2.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 123.068 1.413 . . . . 0.0 110.508 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -59.0 165.1 2.58 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.885 2.474 . . . . 0.0 110.56 168.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.77 -20.64 64.36 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.499 -1.375 . . . . 0.0 113.452 -172.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.4 m -68.29 -43.96 76.52 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.403 1.001 . . . . 0.0 111.287 169.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -60.37 -47.1 87.53 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.556 1.071 . . . . 0.0 111.36 171.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 71.6 mt -64.63 -28.58 69.72 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.118 -0.989 . . . . 0.0 112.369 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 93.6 m -71.8 -41.68 67.98 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.534 0.734 . . . . 0.0 110.841 169.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -75.95 -33.32 59.8 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -175.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.253 1.6 mp -54.21 -41.94 91.27 Favored Pre-proline 0 CA--C 1.554 1.116 0 CA-C-N 119.694 1.134 . . . . 0.0 112.654 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.95 -36.81 5.57 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.193 1.929 . . . . 0.0 113.823 169.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -64.17 -33.43 75.77 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.16 1.345 . . . . 0.0 113.74 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.37 -23.53 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 118.773 0.715 . . . . 0.0 112.809 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.2 mt -80.02 -52.2 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.165 0.986 . . . . 0.0 110.189 173.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -54.33 -51.77 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.817 0.847 . . . . 0.0 110.489 175.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -64.73 -25.6 68.0 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.434 -0.791 . . . . 0.0 112.31 -178.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.83 -48.78 14.1 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.996 -1.002 . . . . 0.0 113.134 172.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -27.58 69.08 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 121.485 1.948 . . . . 0.0 113.851 174.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -70.22 -29.17 65.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.829 1.651 . . . . 0.0 114.032 168.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -133.91 69.91 74.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.706 1.202 . . . . 0.0 112.304 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -55.41 -16.57 14.13 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.232 2.621 . . . . 0.0 116.356 -176.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -85.65 -27.03 25.66 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -64.33 161.3 17.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.156 0.982 . . . . 0.0 112.661 -175.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -81.22 142.0 33.61 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.856 -0.527 . . . . 0.0 110.1 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.87 -35.81 69.33 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.018 0.927 . . . . 0.0 113.34 171.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.413 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -84.85 -28.25 26.18 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -171.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.2 t -62.48 -17.35 59.35 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.132 -0.98 . . . . 0.0 112.085 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -62.66 -6.63 3.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 119.722 -1.861 . . . . 0.0 113.929 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.09 72.5 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.239 1.416 . . . . 0.0 111.665 167.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -30.77 67.46 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -167.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -73.3 -30.16 63.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.814 1.246 . . . . 0.0 113.854 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -106.01 104.2 13.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.449 1.1 . . . . 0.0 112.183 -167.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.4 p -59.44 -37.72 78.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 58.98 179.76 0.08 Allowed 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 126.922 2.089 . . . . 0.0 114.175 -176.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -69.63 -25.74 64.08 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -169.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.3 152.74 85.99 Favored Pre-proline 0 CA--C 1.555 1.147 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -72.73 157.47 51.98 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.819 2.346 . . . . 0.0 111.303 167.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.096 171.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 120.343 0.116 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.289 8.4 t-20 66.96 42.85 2.34 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 172.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -78.92 161.34 26.77 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 163.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -92.97 95.59 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.752 -1.218 . . . . 0.0 113.786 -166.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.88 -36.77 59.61 Favored 'General case' 0 CA--C 1.558 1.277 0 O-C-N 121.16 -0.962 . . . . 0.0 109.932 168.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.408 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 25.2 mtmt -67.99 -12.71 61.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 128.89 2.876 . . . . 0.0 116.284 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -133.21 19.04 4.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.5 ttm -59.78 123.85 18.27 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 169.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -78.04 154.64 31.23 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.34 -0.85 . . . . 0.0 110.327 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.0 m -61.45 -35.09 76.63 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 120.482 -1.386 . . . . 0.0 112.596 -173.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -65.64 -32.33 73.85 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.306 0.957 . . . . 0.0 112.725 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -76.23 -37.83 57.18 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.03 1.332 . . . . 0.0 111.344 174.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -63.95 -49.43 72.6 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.944 0.898 . . . . 0.0 112.614 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.19 -2.99 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -110.79 -8.59 14.53 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.606 1.962 . . . . 0.0 114.089 172.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.6 156.89 35.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.747 1.158 . . . . 0.0 110.177 172.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -66.43 127.53 93.37 Favored Pre-proline 0 N--CA 1.479 0.986 0 O-C-N 121.3 -0.875 . . . . 0.0 109.662 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -46.77 -32.18 11.82 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.683 2.922 . . . . 0.0 113.819 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.517 ' HG2' ' H ' ' A' ' 4' ' ' SER . 57.8 mttt -60.11 -13.82 13.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 99' ' ' ALA . . . . . 0.477 ' HB2' ' HE1' ' A' ' 8' ' ' MET . . . -132.94 22.59 4.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 121.421 1.919 . . . . 0.0 113.123 165.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ttm -67.57 -54.77 17.11 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.677 1.191 . . . . 0.0 111.295 170.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.0 m -48.09 -55.7 17.04 Favored Pre-proline 0 N--CA 1.49 1.54 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.68 -45.42 40.49 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.124 3.216 . . . . 0.0 115.543 174.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.32 -39.99 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.391 1.451 . . . . 0.0 112.935 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.23 -31.86 71.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.185 0.594 . . . . 0.0 110.68 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 67.3 t90 -78.78 -48.61 14.49 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.541 172.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.41 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.7 t90 -64.67 -25.88 68.14 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 117.888 -1.525 . . . . 0.0 110.957 -171.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -62.0 -60.38 3.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.118 1.367 . . . . 0.0 111.17 167.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -27.56 67.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.143 1.377 . . . . 0.0 113.423 -170.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -108.97 5.2 24.06 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 59.52 156.75 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.186 2.594 . . . . 0.0 117.834 -177.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -73.65 -9.69 58.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.56 1.544 . . . . 0.0 112.526 171.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 72.7 p -71.04 162.48 29.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.717 1.607 . . . . 0.0 113.186 -176.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -87.03 148.49 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.403 1.081 . . . . 0.0 110.754 -178.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -80.26 161.83 24.92 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -174.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -136.95 140.72 42.44 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.034 1.734 . . . . 0.0 110.844 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.31 -66.07 0.74 Allowed Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.44 1.019 . . . . 0.0 113.36 -172.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 160.99 125.81 0.79 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.935 1.731 . . . . 0.0 111.522 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -92.63 -13.65 29.27 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.807 0.803 . . . . 0.0 112.817 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 19.4 m 50.4 57.28 6.77 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -166.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 13.0 t -41.8 96.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 127.129 2.172 . . . . 0.0 113.378 -167.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.3 p -144.69 155.08 43.39 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 126.034 1.733 . . . . 0.0 109.201 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 24.0 tp -79.4 74.79 6.01 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.757 1.265 . . . . 0.0 109.728 169.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -58.03 161.25 4.17 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 128.535 2.734 . . . . 0.0 113.795 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -71.03 -22.75 62.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 58.7 m -63.93 -48.23 77.37 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.149 0.886 . . . . 0.0 110.492 171.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.48 -51.9 67.89 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.781 0.719 . . . . 0.0 111.608 171.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.02 -30.44 61.88 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.1 m -81.91 -33.87 30.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.811 0.845 . . . . 0.0 112.347 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -83.17 -31.94 26.86 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.766 -1.112 . . . . 0.0 113.76 -177.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.82 -47.03 86.92 Favored Pre-proline 0 N--CA 1.481 1.1 0 CA-C-N 120.433 1.47 . . . . 0.0 113.038 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.31 -37.64 17.37 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 122.208 1.824 . . . . 0.0 113.318 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -65.42 -36.83 85.11 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.776 -1.203 . . . . 0.0 113.152 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 m -73.25 -28.44 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.777 -0.577 . . . . 0.0 112.49 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 49.7 mt -66.17 -49.23 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-N 118.191 0.45 . . . . 0.0 109.894 170.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.31 -41.61 80.24 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.406 0.683 . . . . 0.0 111.904 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -66.6 -27.53 67.78 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.517 -0.74 . . . . 0.0 112.923 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -76.07 -48.36 21.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.846 0.858 . . . . 0.0 112.184 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -26.47 68.28 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.979 1.263 . . . . 0.0 114.294 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.279 15.2 ptpt -83.73 -10.45 58.12 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 169.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -138.32 61.73 27.35 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.655 1.582 . . . . 0.0 111.439 174.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.81 -14.63 33.16 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.801 3.001 . . . . 0.0 115.847 -169.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -84.99 -14.54 47.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 113.681 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -77.33 160.09 29.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.681 1.192 . . . . 0.0 112.147 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -77.84 139.83 39.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.551 -0.718 . . . . 0.0 109.3 169.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -54.18 -35.76 62.66 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.089 0.956 . . . . 0.0 112.875 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.408 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -87.16 -23.03 24.96 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -170.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.1 t -64.24 -14.61 56.72 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 120.771 -1.206 . . . . 0.0 112.018 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -66.06 -5.17 8.87 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.487 -2.008 . . . . 0.0 114.18 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.01 -30.05 49.84 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 119.929 1.241 . . . . 0.0 111.565 166.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -64.98 -33.68 76.61 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.921 1.289 . . . . 0.0 112.037 -171.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -73.07 -28.8 62.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.528 1.931 . . . . 0.0 115.647 173.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -101.78 109.63 21.43 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -166.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.4 m -78.76 80.58 5.12 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.301 -0.874 . . . . 0.0 110.27 168.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -71.56 176.8 4.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.301 1.04 . . . . 0.0 112.667 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -66.78 -3.73 7.43 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 116.809 2.152 . . . . 0.0 116.809 -168.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.42 145.9 98.19 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 176.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -64.11 156.61 58.07 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.063 2.509 . . . . 0.0 113.614 170.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.602 1.561 . . . . 0.0 111.084 178.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.004 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.254 7.3 t-20 58.23 45.39 17.36 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.52 1.528 . . . . 0.0 114.406 174.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.461 ' HB3' ' HE3' ' B' ' 98' ' ' LYS . 20.2 mm-40 -56.38 -22.74 33.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.802 1.241 . . . . 0.0 113.164 168.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 101.92 100.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 129.462 3.105 . . . . 0.0 114.919 168.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.73 -33.55 73.07 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.313 -1.492 . . . . 0.0 112.588 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.427 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.3 ptpt -74.31 -12.46 60.55 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -106.02 6.08 30.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.452 1.101 . . . . 0.0 112.594 168.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 43.0 ttm -62.02 129.31 40.3 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.724 -1.235 . . . . 0.0 109.722 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.88 155.12 27.92 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.049 -1.032 . . . . 0.0 110.481 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.88 -32.61 74.19 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.264 -1.522 . . . . 0.0 113.417 -175.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.86 -31.47 71.74 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -81.22 -35.0 31.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.39 1.476 . . . . 0.0 111.53 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -57.94 -50.45 73.31 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 121.562 -0.711 . . . . 0.0 112.658 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -69.57 -0.66 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 125.262 1.425 . . . . 0.0 113.042 177.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -111.54 -11.28 14.08 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.351 1.46 . . . . 0.0 114.318 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.42 165.99 24.04 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.188 -0.945 . . . . 0.0 111.622 174.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.423 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 49.9 t-20 -65.74 128.72 94.02 Favored Pre-proline 0 N--CA 1.483 1.191 0 O-C-N 120.941 -1.099 . . . . 0.0 112.542 -177.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 34.2 Cg_exo -57.65 -12.74 12.15 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.556 3.504 . . . . 0.0 116.521 177.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 9.3 mttt -65.75 -67.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.029 1.731 . . . . 0.0 109.672 166.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.64 -6.47 52.18 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 73.6 mtp -57.06 -30.74 64.53 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 121.009 -1.057 . . . . 0.0 112.155 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.267 23.7 m -68.15 -56.1 11.62 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.67 -36.62 82.09 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 123.173 2.582 . . . . 0.0 114.768 168.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.405 HG22 ' HG2' ' B' ' 102' ' ' PRO . 66.2 t -63.74 -53.97 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.504 0.593 . . . . 0.0 111.067 175.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.3 71.37 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.786 1.235 . . . . 0.0 111.685 -177.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.0 t90 -77.68 -52.74 8.49 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 117.575 -1.203 . . . . 0.0 113.459 169.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.494 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 3.0 t90 -66.44 -34.22 77.45 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.761 1.619 . . . . 0.0 111.886 -167.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 58.0 ttp -54.3 -44.2 71.78 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.958 0.903 . . . . 0.0 112.115 169.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.22 -32.67 44.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.281 1.432 . . . . 0.0 112.909 -171.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -121.13 -16.71 7.93 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 62.38 170.67 0.13 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.76 2.6 35.84 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.596 2.358 . . . . 0.0 112.505 172.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.0 p -65.79 14.81 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 128.205 2.602 . . . . 0.0 116.445 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.5 t 61.61 127.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 129.123 2.969 . . . . 0.0 114.26 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.64 156.07 37.71 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.02 0.928 . . . . 0.0 111.825 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.9 mmpt? -82.83 0.86 42.03 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -169.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.71 -25.47 0.1 OUTLIER Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.551 1.072 . . . . 0.0 114.962 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.97 -178.36 50.02 Favored Glycine 0 CA--C 1.538 1.519 0 CA-C-N 118.279 1.039 . . . . 0.0 114.827 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -124.88 24.5 7.62 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.557 1.943 . . . . 0.0 112.453 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.0 m -75.52 65.29 1.73 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.784 1.633 . . . . 0.0 113.508 -168.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -67.56 -15.54 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.667 1.187 . . . . 0.0 112.545 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.39 136.62 53.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.277 1.831 . . . . 0.0 111.727 175.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.8 tp -78.43 77.77 4.91 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.733 1.254 . . . . 0.0 109.839 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -61.11 165.82 4.05 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.857 2.863 . . . . 0.0 113.216 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.83 -24.01 65.23 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.78 -1.2 . . . . 0.0 113.985 -172.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.6 m -65.11 -47.63 76.51 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 119.363 0.983 . . . . 0.0 110.656 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.53 -47.4 84.31 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.897 0.771 . . . . 0.0 111.185 172.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.5 mt -64.24 -25.24 67.97 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.892 -1.13 . . . . 0.0 112.219 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.8 m -77.83 -35.49 51.11 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.701 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -88.49 -27.81 21.23 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.06 -43.64 85.18 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.913 174.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.69 -40.36 10.13 Favored 'Trans proline' 0 C--N 1.352 0.726 0 CA-C-N 122.16 1.807 . . . . 0.0 113.572 169.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -63.35 -37.23 86.48 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.954 1.252 . . . . 0.0 112.928 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 m -68.97 -28.38 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -72.31 -51.43 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 173.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.99 -43.09 77.31 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.141 0.977 . . . . 0.0 111.415 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.29 -30.49 69.51 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.831 -0.543 . . . . 0.0 111.375 -177.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.77 -42.7 57.67 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.11 -0.994 . . . . 0.0 112.807 174.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -31.08 68.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.764 1.62 . . . . 0.0 114.284 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -82.6 -25.71 32.97 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -130.9 73.95 80.5 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.767 1.627 . . . . 0.0 110.603 170.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.52 -11.45 16.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.731 3.621 . . . . 0.0 115.722 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -81.92 -25.14 35.18 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.806 1.642 . . . . 0.0 112.613 -175.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -66.41 154.61 39.69 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.114 0.966 . . . . 0.0 111.395 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -89.62 127.42 35.9 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 174.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.26 -51.5 10.77 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -166.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.427 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -70.92 -6.74 40.75 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.5 p -56.74 -28.21 60.69 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 120.75 -1.219 . . . . 0.0 110.969 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -71.16 -2.26 15.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.515 1.526 . . . . 0.0 114.307 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -83.41 -31.08 26.85 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 111.811 167.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -69.5 -28.69 66.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 111.94 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -75.63 -31.53 59.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.624 1.57 . . . . 0.0 114.988 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -116.28 93.9 4.42 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 112.425 -166.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.3 m -56.99 -42.44 80.26 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.656 1.183 . . . . 0.0 113.339 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.6 t30 61.66 172.55 0.12 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 128.059 2.544 . . . . 0.0 115.737 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -80.23 42.15 0.56 Allowed 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 -167.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -73.53 -33.33 1.84 Allowed Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 174.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -79.83 144.58 17.31 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.669 2.913 . . . . 0.0 114.045 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.584 2.258 0 C-N-CA 125.766 1.626 . . . . 0.0 108.24 171.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.875 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 45.2 t30 55.87 69.21 0.76 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.243 1.817 . . . . 0.0 113.633 -176.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.428 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 20.8 mm-40 -64.1 -9.97 19.69 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.03 1.332 . . . . 0.0 114.019 169.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m 117.99 78.91 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 130.885 3.674 . . . . 0.0 112.665 170.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.4 -39.37 70.11 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.156 -1.59 . . . . 0.0 111.905 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.444 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 2.3 ptpt -78.82 3.63 16.24 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -124.97 9.88 8.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.8 1.24 . . . . 0.0 112.2 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 37.6 ttm -61.5 124.7 21.37 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.476 1.034 . . . . 0.0 109.427 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -76.69 153.24 35.31 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.757 -0.589 . . . . 0.0 110.008 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.93 -28.27 68.16 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.323 -1.486 . . . . 0.0 113.88 -170.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -67.23 -31.85 72.48 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 118.806 0.73 . . . . 0.0 112.551 169.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -75.71 -37.96 59.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.004 1.322 . . . . 0.0 111.28 176.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -67.85 -4.83 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.99 -10.34 17.29 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.957 1.703 . . . . 0.0 113.886 172.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.67 157.77 37.4 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.81 1.187 . . . . 0.0 111.199 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.64 134.75 89.23 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 123.603 0.761 . . . . 0.0 113.036 -178.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -72.59 -7.19 20.42 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.719 1.612 . . . . 0.0 115.947 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' A' ' 3' ' ' GLU . 6.3 mptt -71.3 -53.79 13.05 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.926 1.694 . . . . 0.0 108.712 167.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.32 -15.6 54.92 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 36.3 ttm -54.03 -33.33 57.01 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.636 -0.665 . . . . 0.0 112.6 172.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 30.9 m -65.4 -58.24 12.59 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.773 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' PRO . . . . . 0.405 ' HG2' HG22 ' A' ' 24' ' ' VAL . 7.5 Cg_endo -51.79 -41.98 59.64 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 124.053 3.168 . . . . 0.0 115.033 172.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.92 -42.49 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.637 1.108 . . . . 0.0 113.034 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.69 -29.08 69.85 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.2 t90 -77.56 -51.9 9.93 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 117.728 -1.13 . . . . 0.0 112.16 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -65.84 -29.24 69.67 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.801 1.637 . . . . 0.0 111.21 -169.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 2.8 ttp -65.82 -39.25 90.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.726 1.61 . . . . 0.0 111.895 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -79.1 -34.91 43.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.543 1.137 . . . . 0.0 112.43 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.52 -26.86 27.79 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.168 -1.583 . . . . 0.0 114.239 170.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 70.48 142.62 0.05 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.559 2.344 . . . . 0.0 114.157 -170.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.28 -8.54 57.3 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 7.2 p -62.29 143.66 56.61 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.901 1.28 . . . . 0.0 111.996 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.5 p -70.64 141.35 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -168.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 7.0 m-30 -75.27 171.48 14.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.655 1.582 . . . . 0.0 113.274 -175.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -115.19 26.9 9.76 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.103 1.761 . . . . 0.0 112.635 -169.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.78 -2.21 66.56 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 126.501 2.001 . . . . 0.0 115.228 -174.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.02 166.23 52.72 Favored Glycine 0 CA--C 1.538 1.484 0 CA-C-N 118.524 1.162 . . . . 0.0 114.221 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -111.69 22.09 15.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.861 1.665 . . . . 0.0 113.927 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 14.3 p -71.47 33.72 0.05 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 127.232 2.213 . . . . 0.0 114.625 -175.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 28.8 m -80.95 -4.51 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 O-C-N 120.295 -1.503 . . . . 0.0 112.05 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 22.4 p -66.06 156.7 33.05 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.187 2.195 . . . . 0.0 113.02 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 mp -93.91 149.17 21.46 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.115 0.966 . . . . 0.0 108.795 168.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -143.68 174.66 10.6 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.139 0.976 . . . . 0.0 112.96 -169.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.67 -32.93 73.14 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.098 0.959 . . . . 0.0 113.403 -174.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 65.9 m -70.54 -50.31 38.93 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.717 -0.614 . . . . 0.0 110.174 172.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.25 -55.11 37.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.958 0.903 . . . . 0.0 112.658 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 pp -62.05 -27.27 68.78 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 21.8 m -81.28 -31.49 33.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 122.502 0.321 . . . . 0.0 111.504 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -84.06 -26.1 29.31 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.389 -1.291 . . . . 0.0 114.472 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.16 -42.28 79.81 Favored Pre-proline 0 N--CA 1.482 1.15 0 CA-C-N 121.533 1.969 . . . . 0.0 113.983 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.44 -36.02 5.71 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 CA-C-N 122.487 1.924 . . . . 0.0 113.255 169.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -67.88 -30.78 70.23 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.697 -1.252 . . . . 0.0 113.923 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.0 m -70.9 -31.21 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.989 0.813 . . . . 0.0 111.431 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -68.15 -50.66 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 109.864 171.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -55.19 -44.65 75.48 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.852 0.861 . . . . 0.0 111.571 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.17 -37.03 84.64 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.458 1.026 . . . . 0.0 111.888 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.9 -36.66 78.31 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.456 -0.777 . . . . 0.0 112.189 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -58.3 -51.21 70.73 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.43 1.492 . . . . 0.0 112.648 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 pttt -84.87 -21.58 29.71 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -128.92 76.87 78.65 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.896 1.679 . . . . 0.0 109.672 170.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.09 -9.69 22.72 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.895 3.064 . . . . 0.0 114.957 -176.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -81.96 -21.44 37.2 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.312 1.445 . . . . 0.0 112.833 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -70.37 159.65 33.75 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.441 1.097 . . . . 0.0 111.992 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -92.66 130.26 38.35 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 169.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 65.6 tp -45.33 -47.41 13.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.999 1.32 . . . . 0.0 114.244 -172.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.444 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -72.53 -8.76 56.79 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -174.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 70.3 p -60.53 -24.53 65.44 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.677 -1.264 . . . . 0.0 111.61 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -72.43 -1.18 14.7 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.831 1.253 . . . . 0.0 114.26 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -80.73 -31.85 35.89 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.663 1.12 . . . . 0.0 111.572 165.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -68.75 -29.05 67.37 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.709 1.204 . . . . 0.0 112.465 -169.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.94 -30.01 68.37 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 114.115 169.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -93.44 -45.66 7.68 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 44.2 m 48.27 32.12 2.99 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 125.955 1.702 . . . . 0.0 114.95 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -89.89 163.22 15.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.855 2.062 . . . . 0.0 114.121 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 59.39 -6.6 0.06 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 118.239 2.681 . . . . 0.0 118.239 168.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -147.82 159.84 39.65 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 126.832 2.053 . . . . 0.0 110.845 170.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -62.51 153.47 71.03 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.97 2.447 . . . . 0.0 114.399 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.123 1.769 . . . . 0.0 111.878 178.453 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 121.321 0.582 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.281 46.0 t30 60.29 44.77 12.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.373 1.869 . . . . 0.0 115.583 175.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -67.21 -22.36 65.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.399 164.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.5 m 90.69 99.76 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 129.685 3.194 . . . . 0.0 117.808 165.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.99 -32.4 66.06 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 119.87 -1.769 . . . . 0.0 111.861 169.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 32.0 mttt -58.92 -22.81 60.44 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 126.989 2.116 . . . . 0.0 114.86 175.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -119.29 6.01 11.2 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.895 1.678 . . . . 0.0 112.756 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -61.84 127.41 31.27 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.924 -1.11 . . . . 0.0 109.755 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.58 155.19 28.26 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.292 -0.88 . . . . 0.0 110.022 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.39 -33.84 76.43 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 120.454 -1.404 . . . . 0.0 113.187 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -64.09 -32.24 73.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.774 0.716 . . . . 0.0 112.881 172.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -77.22 -38.18 51.79 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.885 1.274 . . . . 0.0 111.836 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -59.09 -50.37 74.31 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.818 0.847 . . . . 0.0 112.438 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.1 pt -68.36 -5.07 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 124.454 1.102 . . . . 0.0 112.925 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -105.75 -8.98 17.5 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.735 1.614 . . . . 0.0 113.543 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.14 157.89 33.94 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 119.758 1.163 . . . . 0.0 110.462 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -66.83 129.74 94.03 Favored Pre-proline 0 N--CA 1.482 1.132 0 O-C-N 121.216 -0.927 . . . . 0.0 111.426 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -52.17 -27.82 31.18 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.385 2.723 . . . . 0.0 115.019 177.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -51.32 -66.5 0.37 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.769 1.628 . . . . 0.0 111.078 170.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.255 . . -83.07 -4.55 58.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 178.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.2 ttt -64.65 -36.55 84.61 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.857 -1.152 . . . . 0.0 112.211 168.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.9 m -60.45 -51.83 77.22 Favored Pre-proline 0 N--CA 1.478 0.939 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.4 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 10.0 Cg_endo -54.94 -46.3 34.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.16 2.573 . . . . 0.0 115.309 169.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.96 -35.52 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 119.765 1.166 . . . . 0.0 113.154 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.12 -18.34 64.33 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.45 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.2 t90 -95.69 -48.6 5.72 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.181 0.901 . . . . 0.0 111.665 168.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.512 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 56.6 t-105 -64.24 -34.58 78.43 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.563 1.145 . . . . 0.0 111.922 -170.253 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.2 tmm? -67.18 -46.78 72.93 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 124.831 1.252 . . . . 0.0 111.385 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -66.61 -35.1 79.37 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.775 1.23 . . . . 0.0 112.749 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -98.25 -4.05 36.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 57.08 -179.53 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.883 1.673 . . . . 0.0 113.654 -169.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -73.62 41.67 0.12 Allowed 'General case' 0 CA--C 1.555 1.158 0 O-C-N 120.069 -1.645 . . . . 0.0 113.006 172.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 13.5 t -69.58 153.95 42.71 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.133 1.773 . . . . 0.0 114.62 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.42 -4.71 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.454 1.501 . . . . 0.0 113.373 168.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.5 t80 67.15 27.66 8.44 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 53.46 30.65 10.85 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 126.361 1.865 . . . . 0.0 114.498 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.88 1.85 88.73 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.429 1.49 . . . . 0.0 115.254 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.78 -176.61 51.56 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 119.072 1.436 . . . . 0.0 114.076 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -134.11 -14.93 2.31 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -78.71 44.75 0.55 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.941 2.097 . . . . 0.0 114.138 -169.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.63 14.53 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 126.257 1.823 . . . . 0.0 114.465 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.64 152.25 22.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.458 2.303 . . . . 0.0 113.189 -176.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.3 mp -77.12 72.98 3.7 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.508 1.523 . . . . 0.0 110.173 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -67.12 165.64 15.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.935 2.494 . . . . 0.0 112.892 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -67.84 -26.45 66.06 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.085 -1.634 . . . . 0.0 113.47 -171.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.6 m -65.77 -47.86 73.76 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.41 -0.807 . . . . 0.0 110.431 169.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.1 -48.0 76.99 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.615 -0.678 . . . . 0.0 111.198 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.1 -27.37 69.35 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.056 -1.027 . . . . 0.0 112.436 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.0 m -76.39 -35.39 58.65 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.405 1.082 . . . . 0.0 111.615 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.53 -28.17 31.21 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.453 1.024 . . . . 0.0 113.642 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.256 1.5 mp -52.93 -40.68 80.45 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.301 1.41 . . . . 0.0 113.628 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.44 -37.01 3.47 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 122.225 1.83 . . . . 0.0 113.175 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -64.57 -34.3 77.94 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.302 -1.499 . . . . 0.0 113.65 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.74 -15.85 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 174.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.0 mt -91.38 -51.27 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.456 1.102 . . . . 0.0 110.663 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.5 -48.39 71.92 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.942 0.897 . . . . 0.0 110.321 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -65.26 -23.57 67.08 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.282 -0.886 . . . . 0.0 112.62 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.7 -48.42 13.7 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.309 0.959 . . . . 0.0 112.668 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.8 -27.17 69.0 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 120.851 1.66 . . . . 0.0 113.892 174.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -72.5 -31.0 65.01 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.67 1.588 . . . . 0.0 114.884 169.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -130.81 64.52 73.84 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.173 1.389 . . . . 0.0 111.369 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -59.51 -14.87 27.54 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 124.267 3.311 . . . . 0.0 115.726 -172.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -84.61 -20.85 30.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.604 1.562 . . . . 0.0 113.797 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -73.46 162.27 29.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.993 1.317 . . . . 0.0 112.248 -172.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -77.68 154.1 32.45 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.923 -0.486 . . . . 0.0 110.04 169.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.36 -36.7 77.1 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.28 -0.887 . . . . 0.0 113.382 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.3 m-85 -88.05 -21.09 24.95 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 -168.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.3 t -59.16 -22.17 60.53 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.285 -0.884 . . . . 0.0 111.549 170.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -58.67 -16.46 16.4 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 119.555 -1.966 . . . . 0.0 113.394 171.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -58.07 -34.57 70.27 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.31 0.959 . . . . 0.0 112.473 167.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -25.6 67.98 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.962 0.887 . . . . 0.0 112.303 -169.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.344 2.258 . . . . 0.0 113.616 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.24 126.36 46.53 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.083 1.353 . . . . 0.0 112.731 -166.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.2 p -109.05 -8.08 15.24 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -173.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -89.01 13.39 13.03 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.58 17.88 0.49 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -171.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -161.73 160.01 22.63 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.752 2.021 . . . . 0.0 111.719 -177.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -59.66 156.21 38.54 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.34 2.694 . . . . 0.0 113.149 169.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 47.0 t30 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 125.626 1.57 . . . . 0.0 111.877 177.371 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.986 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 65.73 -64.68 0.19 Allowed 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.433 3.093 . . . . 0.0 113.404 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.321 33.3 mm-40 58.57 -26.23 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -170.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 70.7 m 107.48 79.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 131.205 3.802 . . . . 0.0 114.017 167.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.7 -41.49 61.49 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 121.068 -1.02 . . . . 0.0 110.837 172.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.443 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 13.8 mtmt -63.19 -15.1 55.86 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.299 2.239 . . . . 0.0 115.809 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -123.85 7.72 8.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.456 1.502 . . . . 0.0 112.799 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 31.0 ttm -59.6 125.25 22.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.765 1.166 . . . . 0.0 109.353 174.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.56 153.76 33.03 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 -178.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.93 -32.49 73.79 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.427 -1.421 . . . . 0.0 112.8 -173.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -66.52 -30.88 71.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.968 0.804 . . . . 0.0 112.89 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -77.5 -38.69 48.51 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.794 1.238 . . . . 0.0 111.315 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.76 -51.27 70.46 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.486 0.714 . . . . 0.0 112.316 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.2 pt -68.27 -3.29 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.832 0.853 . . . . 0.0 112.861 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -105.72 -9.12 17.45 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 126.053 1.741 . . . . 0.0 114.112 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.57 158.13 36.76 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.828 1.195 . . . . 0.0 111.065 174.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.408 HD21 ' HD2' ' B' ' 98' ' ' LYS . 49.0 t-20 -67.82 132.49 92.39 Favored Pre-proline 0 N--CA 1.485 1.283 0 O-C-N 121.04 -1.037 . . . . 0.0 112.128 -173.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -57.29 -16.91 24.15 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.829 3.019 . . . . 0.0 115.829 175.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.2 mttt -61.89 -64.11 1.04 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.0 1.72 . . . . 0.0 109.458 166.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.2 -4.18 56.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -177.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.8 mmt -52.42 -45.42 65.93 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.61 1.096 . . . . 0.0 111.704 168.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 83.3 m -60.88 -52.8 69.74 Favored Pre-proline 0 N--CA 1.48 1.05 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.877 -172.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -49.87 -49.46 15.96 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.232 3.288 . . . . 0.0 115.202 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.2 p -72.4 -36.41 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 119.485 1.039 . . . . 0.0 112.934 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.98 67.43 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.518 1.127 . . . . 0.0 111.35 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.523 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.6 t90 -84.21 -53.83 5.23 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 117.826 -1.083 . . . . 0.0 110.883 166.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.523 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.9 t90 -62.29 -33.03 73.87 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 116.495 -2.082 . . . . 0.0 113.159 -164.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -59.72 -42.57 93.38 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.225 1.01 . . . . 0.0 112.635 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 -31.51 67.13 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.525 1.93 . . . . 0.0 112.435 -172.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 17.0 m170 -104.85 -12.31 16.33 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 174.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 64.37 166.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.219 2.208 . . . . 0.0 114.457 -168.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.43 20.94 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.188 1.395 . . . . 0.0 113.834 170.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 3.4 t -65.56 170.19 5.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.185 1.394 . . . . 0.0 113.792 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 8.7 p -103.82 147.61 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.074 1.75 . . . . 0.0 108.171 170.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . 0.253 0.5 OUTLIER -77.6 158.87 29.59 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 115.267 1.581 . . . . 0.0 115.267 -168.101 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 5.5 ptpt -149.41 149.35 30.68 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.207 1.403 . . . . 0.0 112.504 -169.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 67.88 5.16 37.84 Favored Glycine 0 CA--C 1.542 1.725 0 N-CA-C 116.589 1.396 . . . . 0.0 116.589 175.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 161.58 -157.88 29.62 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.165 1.364 . . . . 0.0 112.795 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -119.76 15.84 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.472 1.909 . . . . 0.0 113.591 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.57 35.19 0.08 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.684 1.994 . . . . 0.0 114.893 -169.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 34.2 m -64.98 -12.63 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 120.918 -1.114 . . . . 0.0 112.656 169.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.41 145.12 11.82 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.168 1.787 . . . . 0.0 111.703 168.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 70.2 mt -78.78 127.41 32.01 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.589 -0.694 . . . . 0.0 110.699 175.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -92.98 163.87 13.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.773 1.629 . . . . 0.0 110.371 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -63.12 -27.26 69.26 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.589 -1.319 . . . . 0.0 112.05 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 81.2 m -58.77 -41.75 87.35 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.047 0.939 . . . . 0.0 111.21 168.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -72.69 -45.5 58.52 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.653 -0.654 . . . . 0.0 109.995 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -56.32 -30.18 62.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.385 0.674 . . . . 0.0 112.259 173.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.6 m -79.7 -39.4 31.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.222 1.009 . . . . 0.0 112.092 172.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -70.89 -36.67 72.85 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.512 -1.368 . . . . 0.0 113.545 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.97 -41.95 90.66 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.592 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -76.0 -35.47 2.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.094 1.863 . . . . 0.0 113.653 169.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -67.22 -28.05 67.74 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.189 -1.569 . . . . 0.0 114.166 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.1 m -71.2 -24.72 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.843 -0.536 . . . . 0.0 112.035 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 36.7 mt -74.22 -47.95 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.196 0.999 . . . . 0.0 109.965 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -54.65 -48.27 72.51 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.745 0.818 . . . . 0.0 112.029 172.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -68.0 -24.74 65.16 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.792 -1.193 . . . . 0.0 112.151 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -76.54 -47.67 21.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 118.422 -0.799 . . . . 0.0 112.626 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 120.826 1.648 . . . . 0.0 114.047 176.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -69.45 -30.37 68.27 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 167.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -133.7 64.79 69.11 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.975 1.31 . . . . 0.0 112.395 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -58.7 -16.73 32.16 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.101 2.534 . . . . 0.0 116.704 -170.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -83.24 -15.02 51.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.998 1.319 . . . . 0.0 113.347 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.04 162.36 28.11 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.891 1.277 . . . . 0.0 112.007 -172.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -76.98 157.09 31.45 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -73.0 -48.45 36.23 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 174.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.443 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.1 m-85 -77.86 -18.06 56.66 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 116.161 1.911 . . . . 0.0 116.161 -168.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.2 t -58.88 -24.2 61.93 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.383 -0.823 . . . . 0.0 111.686 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -61.51 -4.1 1.22 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 119.787 -1.82 . . . . 0.0 114.242 171.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -71.21 -31.92 68.17 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.705 1.139 . . . . 0.0 112.168 166.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -63.11 -34.13 76.95 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -168.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -70.13 -26.27 63.87 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.824 2.05 . . . . 0.0 114.766 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -99.95 109.8 22.14 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.432 1.493 . . . . 0.0 113.204 -168.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 27.1 m -93.83 0.51 56.28 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -174.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -82.42 7.41 14.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -170.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -76.71 -1.76 29.51 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -149.26 153.28 37.41 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.074 2.15 . . . . 0.0 110.589 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.69 156.62 64.89 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.124 2.549 . . . . 0.0 112.402 171.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.257 0 C-N-CA 125.51 1.524 . . . . 0.0 111.275 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.307 7.5 t-20 65.91 30.22 9.95 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 170.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -58.89 -36.56 74.87 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.689 0.796 . . . . 0.0 110.163 165.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t 80.26 117.5 0.06 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.601 2.761 . . . . 0.0 117.439 167.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.16 -25.41 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.314 -0.866 . . . . 0.0 113.17 175.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -59.82 -30.26 68.8 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.603 1.561 . . . . 0.0 113.097 177.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -107.6 4.62 26.12 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.062 1.745 . . . . 0.0 113.144 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.1 ttm -64.62 124.84 22.93 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.855 -1.153 . . . . 0.0 110.374 175.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.81 155.68 27.75 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.013 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -62.35 -34.38 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.57 -1.331 . . . . 0.0 112.898 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -60.47 -32.03 71.02 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 171.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -82.37 -37.63 25.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.265 1.426 . . . . 0.0 111.602 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.42 -48.39 81.84 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.641 0.777 . . . . 0.0 112.61 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -68.27 -3.66 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 124.18 0.992 . . . . 0.0 112.618 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -111.99 -4.8 14.41 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 125.627 1.571 . . . . 0.0 114.148 176.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.78 159.44 32.92 Favored 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.78 -1.2 . . . . 0.0 111.389 177.136 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -54.01 134.02 58.5 Favored Pre-proline 0 N--CA 1.484 1.227 0 C-N-CA 124.81 1.244 . . . . 0.0 113.8 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.48 -15.49 41.8 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.085 2.523 . . . . 0.0 116.223 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HB2' ' HE2' ' B' ' 87' ' ' MET . 7.2 mptt -71.08 -55.51 8.08 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 120.759 1.618 . . . . 0.0 109.331 170.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.44 -0.18 48.95 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -175.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.76 -40.42 95.08 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.256 23.2 m -66.94 -50.95 40.36 Favored Pre-proline 0 N--CA 1.481 1.093 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -175.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.1 -42.13 47.02 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.607 2.871 . . . . 0.0 115.538 169.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.2 p -73.64 -40.75 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.432 1.014 . . . . 0.0 113.241 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.75 66.65 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.754 0.822 . . . . 0.0 111.494 174.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.494 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 76.7 t90 -87.97 -50.48 6.39 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.05 -1.452 . . . . 0.0 112.104 168.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.42 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 2.0 t90 -67.62 -26.9 66.47 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 121.685 2.039 . . . . 0.0 112.12 -168.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.41 -43.01 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.663 0.785 . . . . 0.0 111.777 169.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.57 -32.88 62.54 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.812 1.645 . . . . 0.0 111.766 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -136.91 107.54 6.55 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.729 2.011 . . . . 0.0 109.695 167.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -72.51 171.93 11.45 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -178.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.82 1.81 1.23 Allowed 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 172.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.5 t -53.14 140.78 24.9 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.751 1.221 . . . . 0.0 111.775 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.37 132.57 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.708 -0.62 . . . . 0.0 110.673 -172.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.53 159.1 34.48 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.99 1.316 . . . . 0.0 113.836 -173.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.5 148.0 35.35 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.636 1.574 . . . . 0.0 112.395 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.36 4.83 65.45 Favored Glycine 0 CA--C 1.543 1.8 0 C-N-CA 124.365 0.983 . . . . 0.0 115.508 -176.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 146.64 -161.45 28.39 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.1 1.809 . . . . 0.0 111.554 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -124.46 -116.17 0.29 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.327 1.051 . . . . 0.0 111.037 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.3 m 63.04 45.06 5.47 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.884 1.274 . . . . 0.0 111.637 -169.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.75 7.78 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 O-C-N 121.2 -0.937 . . . . 0.0 113.483 169.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.404 HG23 HG23 ' B' ' 113' ' ' VAL . 0.0 OUTLIER -52.64 157.45 1.57 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.849 1.659 . . . . 0.0 112.005 168.903 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 tp -72.99 77.85 1.18 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 165.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -73.72 170.76 14.61 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.848 1.659 . . . . 0.0 112.937 -168.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.01 -26.23 66.68 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.235 -1.541 . . . . 0.0 113.746 -171.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 86.2 m -70.33 -40.78 73.93 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.432 -0.792 . . . . 0.0 110.395 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -59.97 -42.6 94.48 Favored 'General case' 0 C--O 1.221 -0.442 0 O-C-N 121.15 -0.969 . . . . 0.0 110.348 174.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.02 -21.52 66.54 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 120.969 -1.082 . . . . 0.0 112.207 177.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.4 m -81.48 -37.42 27.95 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.987 0.915 . . . . 0.0 111.438 169.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -83.74 -28.07 28.48 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.776 1.171 . . . . 0.0 113.864 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.27 -42.88 96.22 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 119.985 1.266 . . . . 0.0 112.152 176.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.53 -35.5 10.3 Favored 'Trans proline' 0 C--N 1.353 0.788 0 CA-C-N 122.145 1.802 . . . . 0.0 113.269 169.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -66.1 -36.33 82.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.109 -1.62 . . . . 0.0 113.671 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.12 -20.78 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.798 0.727 . . . . 0.0 112.573 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 39.3 mt -82.34 -50.67 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.062 0.945 . . . . 0.0 110.558 171.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.25 -38.71 77.43 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 123.853 0.861 . . . . 0.0 111.9 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -69.41 -29.09 66.75 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.954 0.502 . . . . 0.0 111.601 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.6 m -77.19 -46.27 23.88 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.922 174.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -29.47 68.41 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.974 1.716 . . . . 0.0 114.159 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -75.64 -29.08 59.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -134.66 74.63 64.67 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.971 1.309 . . . . 0.0 111.871 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -58.37 -12.44 13.56 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.442 3.428 . . . . 0.0 117.445 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -79.63 -23.95 42.25 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.884 1.273 . . . . 0.0 113.401 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt -64.85 154.66 36.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.37 1.068 . . . . 0.0 112.085 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -80.99 151.58 28.39 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.427 -0.796 . . . . 0.0 109.622 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.0 tp -66.33 -36.55 83.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.86 -1.15 . . . . 0.0 113.132 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.45 -20.94 30.93 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -64.27 -14.54 56.47 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.214 -0.929 . . . . 0.0 112.288 169.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -66.78 -3.52 6.95 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 119.156 -2.215 . . . . 0.0 113.906 169.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -32.77 56.18 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.71 1.204 . . . . 0.0 111.199 165.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -65.69 -29.93 70.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.69 1.596 . . . . 0.0 112.279 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -74.24 -29.61 61.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.579 1.552 . . . . 0.0 114.765 174.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.11 105.86 17.82 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.927 1.291 . . . . 0.0 113.767 -167.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.5 p -68.59 -20.67 64.52 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.024 1.33 . . . . 0.0 113.101 169.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -59.85 105.6 0.4 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.942 1.297 . . . . 0.0 108.92 167.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -167.16 -24.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -172.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -154.49 150.99 22.91 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 125.394 1.477 . . . . 0.0 112.696 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -60.96 135.6 60.33 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.752 2.301 . . . . 0.0 111.436 167.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 125.747 1.619 . . . . 0.0 112.644 179.453 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.29 14.5 t-20 65.77 63.54 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.429 1.892 . . . . 0.0 113.378 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -113.29 163.15 15.19 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 128.383 2.673 . . . . 0.0 104.431 165.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 69.5 m -86.43 91.78 8.63 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.808 1.643 . . . . 0.0 113.378 -165.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.91 -35.67 64.39 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 120.385 -1.447 . . . . 0.0 110.789 170.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.475 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 18.2 mtmt -76.5 -4.33 42.09 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.303 2.241 . . . . 0.0 115.942 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -134.72 17.26 3.58 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.719 1.208 . . . . 0.0 112.207 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' MET . . . . . 0.457 ' HE2' ' HB2' ' A' ' 19' ' ' LYS . 58.6 ttm -59.63 134.44 57.02 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 121.292 -0.88 . . . . 0.0 108.711 170.186 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -72.02 166.94 21.2 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.468 1.128 . . . . 0.0 112.176 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.69 -31.27 68.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.212 170.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -65.45 -38.36 89.61 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.055 0.843 . . . . 0.0 112.397 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -68.76 -41.57 78.7 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 121.459 -0.776 . . . . 0.0 112.094 172.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -59.46 -47.71 84.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.616 0.644 . . . . 0.0 111.947 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -71.27 -13.26 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.676 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.46 -24.42 20.71 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.467 1.031 . . . . 0.0 113.547 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.03 155.47 36.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.38 1.072 . . . . 0.0 112.139 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -75.16 139.4 72.45 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -65.58 -16.5 54.0 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 121.918 1.745 . . . . 0.0 116.238 -172.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -60.08 -61.11 2.85 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.672 -1.268 . . . . 0.0 110.46 168.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.1 -8.99 57.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -177.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -57.31 -40.66 78.35 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.02 -1.05 . . . . 0.0 110.911 168.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.5 m -57.87 -57.77 23.3 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.39 1.076 . . . . 0.0 113.113 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.78 -40.54 79.73 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 124.12 3.213 . . . . 0.0 115.791 172.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -76.8 -36.56 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 CA-C-N 120.717 1.599 . . . . 0.0 113.355 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.02 -29.48 69.74 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.755 0.822 . . . . 0.0 111.03 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.518 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 67.5 t90 -80.06 -53.05 7.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 117.869 -1.062 . . . . 0.0 112.772 169.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.518 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.17 -30.05 70.44 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 117.909 -1.516 . . . . 0.0 111.305 -168.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -58.56 -34.5 71.12 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.705 0.802 . . . . 0.0 112.896 171.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -78.87 -17.39 55.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.442 1.897 . . . . 0.0 114.468 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' HIS . . . . . 0.446 ' CE1' HD21 ' B' ' 154' ' ' ASN . 0.2 OUTLIER -131.12 -19.86 2.8 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -173.235 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 63.76 160.25 0.09 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 129.797 3.239 . . . . 0.0 117.443 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -73.46 29.33 0.07 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.155 2.182 . . . . 0.0 114.44 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 t -78.63 177.72 8.39 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.505 1.922 . . . . 0.0 113.509 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' VAL . . . . . 0.404 HG23 HG23 ' A' ' 42' ' ' THR . 65.9 t -101.29 132.05 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.934 1.694 . . . . 0.0 106.475 168.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -75.85 153.94 36.47 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -167.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -145.62 155.9 43.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.501 1.521 . . . . 0.0 112.836 -169.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.01 -106.53 1.95 Allowed Glycine 0 CA--C 1.534 1.265 0 C-N-CA 123.763 0.697 . . . . 0.0 111.82 -174.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.99 -155.13 7.52 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.621 1.105 . . . . 0.0 113.547 172.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -122.03 22.26 10.33 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.196 1.399 . . . . 0.0 112.537 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 11.4 p -75.0 42.13 0.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.853 2.061 . . . . 0.0 115.353 -170.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 34.6 m -65.37 -17.67 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.499 1.12 . . . . 0.0 111.263 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.46 155.71 5.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.609 2.364 . . . . 0.0 112.163 167.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 52.3 mt -65.21 121.94 15.94 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.62 -0.675 . . . . 0.0 110.179 168.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -90.87 161.1 15.38 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.128 1.371 . . . . 0.0 109.697 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -64.12 -26.25 68.45 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.31 -1.494 . . . . 0.0 112.29 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 35.4 m -63.99 -41.44 97.52 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.517 -0.739 . . . . 0.0 111.457 169.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -62.77 -50.94 69.06 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.574 1.079 . . . . 0.0 110.129 174.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.2 mt -56.83 -31.53 64.83 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.812 0.845 . . . . 0.0 112.544 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 38.1 m -80.71 -35.98 32.82 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.928 0.891 . . . . 0.0 112.144 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -81.73 -30.01 32.66 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.93 -40.51 72.4 Favored Pre-proline 0 CA--C 1.555 1.148 0 CA-C-N 120.525 1.511 . . . . 0.0 113.723 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -74.05 -37.46 2.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 CA-C-N 122.067 1.774 . . . . 0.0 113.632 169.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -67.68 -30.27 69.75 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 120.372 -1.455 . . . . 0.0 114.181 -174.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -67.64 -24.22 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.584 . . . . 0.0 112.379 173.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 48.9 mt -72.87 -53.16 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.209 1.004 . . . . 0.0 109.734 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -55.26 -53.74 52.24 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.469 0.707 . . . . 0.0 110.967 176.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.81 -24.96 67.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.191 -0.943 . . . . 0.0 112.816 -177.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -78.82 -47.62 16.31 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.648 1.113 . . . . 0.0 112.314 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -25.28 67.94 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 120.93 1.695 . . . . 0.0 113.463 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -74.81 -26.85 60.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.455 1.502 . . . . 0.0 114.959 169.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -135.85 62.49 47.39 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.331 1.453 . . . . 0.0 110.871 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.47 -16.0 39.42 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.577 2.851 . . . . 0.0 114.773 -171.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -78.39 -23.88 46.58 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.973 1.709 . . . . 0.0 114.283 -177.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -67.1 164.42 18.0 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.27 1.428 . . . . 0.0 112.901 -173.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.37 131.04 37.12 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 168.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.6 tp -46.03 -37.99 7.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.739 1.616 . . . . 0.0 113.728 179.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 7.2 m-85 -78.31 -8.64 58.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.0 p -65.44 -24.3 67.15 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 120.786 -1.197 . . . . 0.0 111.636 168.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -72.97 -2.48 21.18 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -80.04 -32.11 39.51 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.663 1.12 . . . . 0.0 111.632 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -68.33 -30.85 69.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.744 0.818 . . . . 0.0 112.078 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -73.34 -28.56 62.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.258 1.823 . . . . 0.0 115.253 169.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -133.69 80.1 1.85 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.189 1.395 . . . . 0.0 114.021 -165.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 45.8 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.966 168.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 154' ' ' ASN . . . . . 0.446 HD21 ' CE1' ' B' ' 109' ' ' HIS . 35.0 p-10 -70.15 -54.18 14.03 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 -168.359 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -161.68 -34.65 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.72 1.608 . . . . 0.0 114.429 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -65.11 147.81 98.29 Favored Pre-proline 0 CA--C 1.552 1.057 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -170.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.0 151.5 71.61 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.293 2.662 . . . . 0.0 114.091 175.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 125.816 1.646 . . . . 0.0 113.191 178.084 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.979 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.0 t30 57.23 46.68 18.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.932 1.693 . . . . 0.0 114.428 179.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.407 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 19.8 mm-40 -58.45 -26.36 63.25 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.201 167.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 t 100.24 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.261 3.024 . . . . 0.0 115.138 169.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.79 -26.28 68.56 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.073 -1.642 . . . . 0.0 111.01 169.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HD3' ' CE1' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -67.15 -20.26 65.72 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.961 2.104 . . . . 0.0 113.782 175.452 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -115.58 5.2 14.31 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.937 1.295 . . . . 0.0 113.29 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.1 ttm -62.62 123.24 17.84 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.017 -1.052 . . . . 0.0 109.977 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -79.17 155.4 28.67 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.227 -0.921 . . . . 0.0 110.695 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.11 -34.97 75.8 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.604 -1.31 . . . . 0.0 112.831 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -61.62 -33.38 73.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.95 0.796 . . . . 0.0 112.95 172.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -78.63 -37.36 42.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.994 1.318 . . . . 0.0 111.607 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.81 -49.64 76.91 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.613 0.765 . . . . 0.0 112.409 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.6 pt -68.38 -5.87 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.324 1.05 . . . . 0.0 112.896 177.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -105.16 -8.84 18.13 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.412 1.485 . . . . 0.0 113.494 174.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.36 159.87 31.8 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 120.957 -1.089 . . . . 0.0 111.203 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -67.64 130.08 93.23 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.039 -1.038 . . . . 0.0 112.187 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.79 -16.99 12.48 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.809 3.673 . . . . 0.0 116.396 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HG3' ' C ' ' B' ' 82' ' ' GLU . 11.9 mttt -64.4 -67.62 0.42 Allowed 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.813 2.045 . . . . 0.0 108.649 166.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.84 -10.45 59.51 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.38 -34.91 73.0 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.272 19.1 m -66.3 -52.65 36.24 Favored Pre-proline 0 N--CA 1.481 1.081 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -50.98 -43.95 44.81 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.368 2.712 . . . . 0.0 115.469 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.3 p -73.04 -38.45 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-N 119.218 0.917 . . . . 0.0 113.095 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.21 -20.51 66.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.254 1.022 . . . . 0.0 111.783 174.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.474 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 58.4 t90 -88.65 -51.2 5.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.81 168.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.426 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 1.9 t90 -69.2 -31.08 69.44 Favored 'General case' 0 C--N 1.351 0.63 0 CA-C-N 120.025 1.284 . . . . 0.0 112.252 -168.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -63.92 -43.84 94.7 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.625 0.77 . . . . 0.0 110.995 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -71.23 -34.39 70.75 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.592 1.157 . . . . 0.0 112.802 -173.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -97.3 -2.31 42.84 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.407 ' HG2' ' H ' ' A' ' 32' ' ' GLU . 7.8 tt0 61.69 173.32 0.12 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.825 1.65 . . . . 0.0 112.989 -168.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.407 ' H ' ' HG2' ' A' ' 31' ' ' GLU . 45.7 mt-10 -76.37 48.48 0.53 Allowed 'General case' 0 N--CA 1.478 0.957 0 O-C-N 120.518 -1.364 . . . . 0.0 112.991 -175.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.5 t -148.48 173.94 12.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.553 1.941 . . . . 0.0 112.074 -173.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.409 ' H ' HG13 ' B' ' 120' ' ' VAL . 53.8 t -125.01 155.04 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.591 1.956 . . . . 0.0 107.82 169.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.58 160.1 11.97 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -81.39 4.37 21.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.081 1.352 . . . . 0.0 114.558 -169.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 178.6 -36.72 0.08 OUTLIER Glycine 0 CA--C 1.539 1.542 0 C-N-CA 125.127 1.346 . . . . 0.0 113.755 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -71.28 169.82 48.87 Favored Glycine 0 CA--C 1.54 1.634 0 CA-C-N 117.887 0.843 . . . . 0.0 113.4 169.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -142.06 -0.21 1.32 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 -172.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -77.94 54.79 1.34 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.221 1.408 . . . . 0.0 112.371 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.9 m -61.47 -11.74 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 125.555 1.542 . . . . 0.0 113.068 172.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -39.78 141.25 0.44 Allowed 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.59 2.356 . . . . 0.0 111.759 168.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 30.4 mt -70.07 76.39 0.5 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.881 0.848 . . . . 0.0 109.913 168.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -69.41 175.61 3.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.737 2.015 . . . . 0.0 112.411 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.65 -23.03 64.37 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.742 -1.849 . . . . 0.0 113.771 -172.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.3 m -71.1 -42.0 69.86 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.255 0.934 . . . . 0.0 110.483 169.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.9 -49.1 77.89 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.548 -0.72 . . . . 0.0 111.795 170.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.07 -22.3 66.94 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.129 -0.982 . . . . 0.0 111.812 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.9 m -79.17 -36.87 39.66 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.172 0.989 . . . . 0.0 111.67 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -82.65 -33.59 27.74 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.551 -1.343 . . . . 0.0 113.876 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.43 -42.38 87.28 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.696 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.41 -37.93 7.0 Favored 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 122.119 1.793 . . . . 0.0 113.385 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -67.02 -34.45 77.75 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.149 -1.594 . . . . 0.0 113.68 -176.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.6 m -67.52 -16.2 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 173.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.7 mt -90.58 -50.73 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.221 1.408 . . . . 0.0 110.687 172.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.28 -39.14 78.46 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.309 1.043 . . . . 0.0 111.482 177.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -70.14 -24.29 63.15 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.14 -0.975 . . . . 0.0 111.52 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.82 -44.8 17.91 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.999 0.92 . . . . 0.0 112.031 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -27.69 69.37 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 120.666 1.575 . . . . 0.0 113.526 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -69.56 -35.12 75.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 168.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -130.04 65.78 76.21 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.682 1.193 . . . . 0.0 112.263 -178.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -55.71 -14.43 10.43 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.53 2.82 . . . . 0.0 117.033 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -84.85 -21.41 29.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.375 1.47 . . . . 0.0 113.65 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -70.07 158.32 35.92 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.327 1.051 . . . . 0.0 111.981 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -94.91 133.37 38.72 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.4 tp -49.64 -42.81 46.07 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -168.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CE1' ' HD3' ' A' ' 6' ' ' LYS . 7.5 m-85 -75.0 -8.56 56.86 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -178.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 69.0 p -60.41 -27.37 67.4 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.349 -1.47 . . . . 0.0 111.517 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -72.87 -3.85 28.22 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.76 1.224 . . . . 0.0 113.7 177.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -79.73 -30.95 41.05 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.338 0.972 . . . . 0.0 111.747 168.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -69.71 -26.03 64.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.72 1.208 . . . . 0.0 112.243 -170.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -76.88 -31.82 57.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.843 1.657 . . . . 0.0 114.872 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -97.81 110.66 23.19 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.304 1.042 . . . . 0.0 113.658 -167.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -133.26 106.94 7.84 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.709 1.203 . . . . 0.0 110.913 170.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -143.47 -52.07 0.35 Allowed 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.99 -4.66 57.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -166.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -143.76 150.02 48.69 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 124.981 1.312 . . . . 0.0 113.634 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.98 161.65 45.37 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.233 2.622 . . . . 0.0 112.152 170.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 . . . . . 0 C--O 1.249 1.055 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 174.873 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.982 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 49.1 t30 57.86 50.14 10.93 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.795 1.638 . . . . 0.0 114.226 177.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.407 ' C ' ' HG3' ' A' ' 19' ' ' LYS . 34.9 mm-40 -63.39 -16.87 61.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 0.0 113.139 168.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.1 t 101.62 95.09 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.68 3.192 . . . . 0.0 116.305 168.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.22 -37.39 77.38 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.339 -1.476 . . . . 0.0 112.202 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.3 ptpt -76.01 -13.22 60.23 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -107.92 7.26 27.91 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.656 1.183 . . . . 0.0 113.051 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 40.5 ttm -62.55 128.66 37.02 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.795 -1.19 . . . . 0.0 109.829 173.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -77.17 154.55 33.04 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 120.929 -1.107 . . . . 0.0 110.744 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.16 -33.67 74.95 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.225 -1.547 . . . . 0.0 113.277 -174.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -30.79 71.15 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 119.171 0.896 . . . . 0.0 112.22 173.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -76.54 -37.23 56.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.677 1.191 . . . . 0.0 111.504 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.25 -49.63 76.33 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.418 -0.801 . . . . 0.0 113.022 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 9.0 pt -66.61 -8.86 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -102.08 -12.14 18.33 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.114 1.766 . . . . 0.0 114.015 173.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.51 157.73 37.35 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.616 1.098 . . . . 0.0 111.45 176.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.449 HD21 ' CD ' ' B' ' 98' ' ' LYS . 1.7 t-20 -57.51 134.66 82.06 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.421 1.088 . . . . 0.0 113.458 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 13.6 Cg_exo -75.92 -6.32 17.3 Favored 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 121.483 1.456 . . . . 0.0 115.176 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.449 ' CD ' HD21 ' B' ' 96' ' ' ASN . 6.3 mptt -70.04 -55.28 9.94 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.454 1.479 . . . . 0.0 109.207 168.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.72 -9.61 55.53 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -178.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.2 ttm -56.06 -30.91 62.64 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 120.243 -1.536 . . . . 0.0 112.731 169.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.7 m -66.05 -57.2 13.96 Favored Pre-proline 0 N--CA 1.482 1.153 0 CA-C-O 117.813 -1.089 . . . . 0.0 112.603 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.43 -36.43 79.41 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.916 3.077 . . . . 0.0 114.113 169.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.06 -53.29 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 119.275 0.943 . . . . 0.0 111.196 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.16 75.22 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.235 1.014 . . . . 0.0 111.257 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.491 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.9 t90 -69.37 -53.68 18.29 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 117.649 -1.167 . . . . 0.0 112.22 169.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.491 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.6 t90 -65.09 -32.35 74.02 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.03 -1.468 . . . . 0.0 111.998 -167.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 62.8 ttp -53.63 -46.03 70.36 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.544 1.137 . . . . 0.0 111.893 169.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -76.19 -21.54 56.37 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.015 1.326 . . . . 0.0 113.841 -178.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -149.05 81.41 1.43 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.417 1.087 . . . . 0.0 110.969 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.79 161.14 29.12 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 117.044 2.238 . . . . 0.0 117.044 -167.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.44 17.92 0.25 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 115.491 1.663 . . . . 0.0 115.491 172.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 40.4 p -73.67 38.26 0.1 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.341 1.857 . . . . 0.0 113.994 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . 0.267 46.0 t 65.01 133.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.971 3.709 . . . . 0.0 113.348 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -81.54 60.67 4.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -166.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt -63.06 -10.5 14.54 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.792 2.037 . . . . 0.0 115.985 -173.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -70.01 -14.17 70.49 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 124.719 1.152 . . . . 0.0 115.127 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 79.88 64.23 1.9 Allowed Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.846 1.323 . . . . 0.0 113.139 176.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.351 4.7 p-10 48.44 38.62 11.14 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 174.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 27.5 p -64.49 -30.38 71.41 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.008 -1.058 . . . . 0.0 111.53 166.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 120' ' ' VAL . . . . . 0.409 HG13 ' H ' ' A' ' 34' ' ' VAL . 83.9 t 63.73 127.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 130.776 3.63 . . . . 0.0 117.208 172.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . 0.255 1.2 t 54.35 -177.38 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.767 2.827 . . . . 0.0 117.708 167.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 2.3 pp -67.42 166.46 14.54 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 128.417 2.687 . . . . 0.0 114.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -133.95 -178.82 5.2 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.817 2.047 . . . . 0.0 111.44 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.14 -24.38 67.39 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.637 -1.289 . . . . 0.0 114.021 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 52.2 m -65.57 -38.69 90.28 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.265 -0.897 . . . . 0.0 111.062 169.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -66.2 -44.14 84.74 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.836 1.198 . . . . 0.0 110.655 175.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.4 mt -57.07 -26.29 60.15 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.3 m -83.54 -32.41 25.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.918 1.287 . . . . 0.0 112.597 173.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -78.71 -34.51 45.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.775 -1.203 . . . . 0.0 113.447 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.49 -38.26 60.04 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 117.379 -1.296 . . . . 0.0 113.474 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -75.6 -37.55 1.7 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 CA-C-N 122.246 1.838 . . . . 0.0 113.18 168.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -64.02 -33.52 75.93 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.593 -1.317 . . . . 0.0 113.766 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.53 -26.4 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.575 0.75 . . . . 0.0 112.789 178.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 52.3 mt -69.42 -50.1 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.632 0.773 . . . . 0.0 109.323 171.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.4 -42.49 91.9 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.055 0.942 . . . . 0.0 111.878 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.57 -25.7 65.03 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.735 -1.228 . . . . 0.0 112.117 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.54 -45.38 25.58 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.288 -0.883 . . . . 0.0 111.829 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -27.29 68.77 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.459 1.481 . . . . 0.0 113.652 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -71.11 -36.04 72.0 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 168.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -127.51 62.62 55.61 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.234 1.414 . . . . 0.0 110.727 -176.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.83 -13.63 27.8 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.521 2.814 . . . . 0.0 114.786 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -81.69 -23.66 36.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.132 1.773 . . . . 0.0 114.304 -178.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -66.26 156.93 32.86 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.84 1.256 . . . . 0.0 112.072 -175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -89.57 131.78 35.41 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.1 tp -48.17 -52.35 21.11 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -168.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.88 -8.03 40.2 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -174.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 72.6 p -57.59 -27.29 62.59 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 120.539 -1.351 . . . . 0.0 111.118 168.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -71.22 -3.86 22.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.469 1.508 . . . . 0.0 114.48 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -34.55 40.6 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.772 1.169 . . . . 0.0 111.655 167.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.75 -31.41 66.63 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.018 1.327 . . . . 0.0 112.392 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -66.06 -30.31 70.81 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.306 1.442 . . . . 0.0 114.456 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.47 -59.44 1.7 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -167.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m 32.34 56.14 0.37 Allowed 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 126.609 1.963 . . . . 0.0 114.73 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -69.26 -23.06 63.81 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -173.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -142.97 179.01 7.28 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.389 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . 0.313 0.4 OUTLIER 55.91 150.56 0.05 OUTLIER Pre-proline 0 CA--C 1.56 1.331 0 C-N-CA 130.931 3.692 . . . . 0.0 116.505 -169.177 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.78 155.14 50.66 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.231 2.62 . . . . 0.0 114.101 173.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.94 1.696 . . . . 0.0 112.802 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.05 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.348 9.1 t-20 69.97 30.17 3.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.126 1.899 . . . . 0.0 116.126 174.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.86 160.53 32.01 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 105.12 -2.178 . . . . 0.0 105.12 160.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 t -104.73 116.1 31.45 Favored 'General case' 0 CA--C 1.505 -0.756 0 O-C-N 120.585 -1.322 . . . . 0.0 112.313 -166.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.14 -32.82 73.36 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.091 167.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.429 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.4 mtmt -63.24 -28.96 70.39 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.504 1.922 . . . . 0.0 114.209 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -113.59 10.44 18.07 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.236 1.414 . . . . 0.0 112.647 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.458 ' HE2' ' HB2' ' B' ' 98' ' ' LYS . 12.7 ttm -64.29 123.43 19.12 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.726 -1.234 . . . . 0.0 108.616 170.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.8 t -79.36 157.85 27.55 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.117 -0.989 . . . . 0.0 110.695 -174.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.53 -35.6 78.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.587 -1.32 . . . . 0.0 112.84 -174.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -61.24 -33.44 73.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -79.9 -38.48 32.47 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.12 1.368 . . . . 0.0 111.67 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -59.19 -49.65 77.04 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.991 0.917 . . . . 0.0 112.705 176.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -67.71 -5.15 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 C-N-CA 124.362 1.065 . . . . 0.0 112.641 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -107.26 -6.83 17.01 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.325 1.45 . . . . 0.0 113.707 173.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.02 160.82 29.44 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.915 -1.115 . . . . 0.0 110.94 175.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 41.9 t-20 -64.78 131.08 95.05 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 121.157 -0.964 . . . . 0.0 111.999 -176.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 29.7 Cg_exo -60.61 -16.53 43.54 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.437 2.758 . . . . 0.0 114.969 -178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -60.27 -67.39 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.717 1.607 . . . . 0.0 110.161 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.12 -3.74 53.02 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 ttt -57.71 -40.46 79.57 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 169.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -64.83 -54.18 37.35 Favored Pre-proline 0 N--CA 1.481 1.125 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -48.97 -44.41 32.52 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.732 2.955 . . . . 0.0 115.886 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.1 p -72.5 -42.25 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.28 -35.69 70.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.877 0.471 . . . . 0.0 110.229 171.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 75.1 t90 -76.3 -49.84 15.9 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.587 177.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.422 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 1.4 t90 -64.75 -25.33 67.88 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 120.383 1.447 . . . . 0.0 111.264 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -66.92 -50.71 61.52 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.422 1.489 . . . . 0.0 111.693 168.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -37.57 87.72 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.543 1.137 . . . . 0.0 113.765 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -121.53 96.7 5.18 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.844 1.658 . . . . 0.0 109.164 174.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.95 149.84 35.24 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -177.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -76.34 -3.54 37.34 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.589 1.956 . . . . 0.0 114.115 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.5 p -74.16 25.72 0.08 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.524 1.93 . . . . 0.0 115.624 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 57.7 t 59.35 133.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 128.875 2.87 . . . . 0.0 115.018 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -76.55 158.29 31.32 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.7 -1.25 . . . . 0.0 113.171 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -142.64 49.58 1.49 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.582 1.553 . . . . 0.0 112.067 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.43 -8.62 0.04 OUTLIER Glycine 0 CA--C 1.542 1.738 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.85 -173.69 40.2 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.447 1.623 . . . . 0.0 114.332 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -113.87 47.43 1.19 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.886 2.474 . . . . 0.0 110.658 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.88 24.23 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 128.8 2.84 . . . . 0.0 117.166 -168.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.21 -21.44 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 O-C-N 120.367 -1.458 . . . . 0.0 112.086 170.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 12.6 p -56.32 141.64 40.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.817 1.647 . . . . 0.0 112.826 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.9 mt -92.54 150.31 20.83 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.119 0.568 . . . . 0.0 110.263 169.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -145.43 170.78 15.68 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.801 1.241 . . . . 0.0 111.527 -173.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.22 -27.27 67.1 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.837 -1.164 . . . . 0.0 113.489 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.3 m -63.62 -51.99 62.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.967 0.803 . . . . 0.0 110.133 169.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.83 -49.55 70.77 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.354 0.525 . . . . 0.0 110.365 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.0 mt -61.22 -33.61 73.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.892 0.877 . . . . 0.0 112.412 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.2 m -72.9 -35.91 67.19 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.424 1.09 . . . . 0.0 111.404 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm100 -78.52 -24.06 45.94 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.759 -1.115 . . . . 0.0 113.134 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.95 -47.93 95.45 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 120.352 1.433 . . . . 0.0 112.399 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.48 -34.1 21.09 Favored 'Trans proline' 0 C--N 1.354 0.864 0 CA-C-N 121.865 1.702 . . . . 0.0 113.342 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -67.58 -34.33 76.82 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.502 1.501 . . . . 0.0 114.057 -177.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.13 -20.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.77 0.714 . . . . 0.0 112.79 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.83 -50.37 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.501 1.121 . . . . 0.0 110.781 171.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.56 -39.07 79.25 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.9 0.88 . . . . 0.0 111.783 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -69.23 -28.81 66.68 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.434 0.561 . . . . 0.0 111.627 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.7 m -77.68 -46.72 21.1 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.293 -0.88 . . . . 0.0 112.921 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -28.96 67.55 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.85 1.659 . . . . 0.0 114.334 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -75.0 -30.23 61.08 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 173.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -134.13 75.4 65.88 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.098 1.359 . . . . 0.0 112.137 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -59.27 -9.59 8.79 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.405 3.403 . . . . 0.0 117.297 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -81.9 -21.68 37.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.351 1.46 . . . . 0.0 113.129 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -68.76 160.35 30.58 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.809 1.244 . . . . 0.0 111.387 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -83.7 152.04 24.94 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.619 -0.676 . . . . 0.0 110.759 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.9 tp -67.5 -35.4 79.06 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.08 -1.012 . . . . 0.0 113.357 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -90.91 -23.85 20.37 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -58.83 -23.6 60.8 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.366 -0.834 . . . . 0.0 111.675 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -61.46 -4.77 1.41 Allowed 'General case' 0 CA--C 1.539 0.548 0 O-C-N 119.692 -1.88 . . . . 0.0 113.696 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -35.17 67.05 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 120.957 -1.089 . . . . 0.0 111.945 167.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.77 -30.51 71.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.916 0.886 . . . . 0.0 113.249 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.416 ' HG2' ' H ' ' A' ' 72' ' ' GLN . 8.9 pt20 -73.56 -23.14 59.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.729 1.612 . . . . 0.0 114.395 173.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.1 14.95 18.38 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.0 2.12 . . . . 0.0 116.015 -166.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 57.9 m -66.77 81.01 0.11 Allowed 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -176.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -123.86 -1.39 8.38 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 127.399 2.28 . . . . 0.0 113.002 169.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -71.97 -41.97 67.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 128.222 2.609 . . . . 0.0 111.998 170.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -150.52 151.84 31.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.421 1.889 . . . . 0.0 112.336 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -72.01 157.93 53.5 Favored 'Trans proline' 0 N--CA 1.44 -1.654 0 C-N-CA 122.633 2.222 . . . . 0.0 110.668 167.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 27.7 m120 . . . . . 0 C--O 1.276 2.487 0 C-N-CA 125.624 1.569 . . . . 0.0 108.26 173.332 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.154 0 CA-C-O 120.892 0.377 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.266 0.6 OUTLIER 67.72 54.12 0.66 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 123.22 1.486 . . . . 0.0 113.029 173.201 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -97.5 157.63 15.91 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 103.795 -2.668 . . . . 0.0 103.795 165.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.2 m -86.44 86.52 7.34 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 125.019 1.328 . . . . 0.0 113.416 -164.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.31 53.53 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.084 1.311 . . . . 0.0 111.033 171.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.409 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 9.4 ptpt -77.67 -0.51 26.96 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.958 2.103 . . . . 0.0 116.411 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -136.45 19.07 3.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.979 1.312 . . . . 0.0 112.233 170.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.4 ttm -60.75 123.22 16.86 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.899 -1.126 . . . . 0.0 108.192 169.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.76 153.87 32.49 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.577 -0.702 . . . . 0.0 109.963 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -61.51 -33.48 73.88 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.805 -1.185 . . . . 0.0 112.991 -173.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -65.94 -30.99 71.66 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.024 0.829 . . . . 0.0 112.975 173.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -77.33 -37.89 51.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.976 1.311 . . . . 0.0 111.101 173.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -62.78 -48.98 76.78 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.446 -0.784 . . . . 0.0 112.702 177.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.6 pt -69.21 -4.11 3.44 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 123.597 0.759 . . . . 0.0 112.977 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.8 -12.62 16.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.145 1.778 . . . . 0.0 114.124 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 159.78 32.87 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 119.763 1.165 . . . . 0.0 110.849 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 51.8 t-20 -66.66 129.09 94.11 Favored Pre-proline 0 N--CA 1.483 1.206 0 O-C-N 121.384 -0.822 . . . . 0.0 111.165 -177.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 31.2 Cg_exo -59.77 -18.17 47.19 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.927 2.418 . . . . 0.0 114.786 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.458 ' HB2' ' HE2' ' A' ' 8' ' ' MET . 32.1 mttp -56.14 -66.76 0.38 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.184 1.793 . . . . 0.0 109.495 168.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.5 -7.22 59.55 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 17.3 ttm -56.82 -43.27 80.86 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.958 -1.089 . . . . 0.0 111.544 169.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 60.3 m -55.61 -57.48 20.88 Favored Pre-proline 0 N--CA 1.484 1.228 0 CA-C-O 118.036 -0.983 . . . . 0.0 113.551 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -52.93 -43.39 57.06 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.21 3.273 . . . . 0.0 115.621 172.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.2 p -73.92 -39.24 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 120.235 1.38 . . . . 0.0 113.263 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.29 -29.89 69.12 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.086 0.954 . . . . 0.0 111.061 172.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.51 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 61.1 t90 -79.37 -53.49 6.87 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.353 169.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.51 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.5 t90 -64.55 -29.9 70.93 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 120.903 1.683 . . . . 0.0 112.65 -167.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -61.36 -51.28 69.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.355 1.062 . . . . 0.0 111.415 171.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -27.98 65.95 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.671 1.588 . . . . 0.0 111.666 -178.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' HIS . . . . . 0.485 ' CG ' HD22 ' B' ' 154' ' ' ASN . 14.6 t60 -148.24 96.19 2.58 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.504 1.122 . . . . 0.0 111.72 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.0 166.62 21.84 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -171.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 1.19 1.21 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.776 1.63 . . . . 0.0 115.378 171.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 13.5 t -58.64 144.23 43.88 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.085 -1.009 . . . . 0.0 111.845 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 79.6 t -66.03 131.86 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 O-C-N 121.65 -0.656 . . . . 0.0 111.513 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -67.74 167.05 14.03 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.989 1.316 . . . . 0.0 113.358 -176.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.0 -0.84 23.06 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 155.52 -23.42 0.57 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.139 1.352 . . . . 0.0 114.618 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.71 168.41 54.27 Favored Glycine 0 CA--C 1.538 1.51 0 CA-C-N 118.211 1.006 . . . . 0.0 115.08 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.9 p30 -128.15 13.16 6.68 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.654 1.982 . . . . 0.0 113.113 174.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 7.0 p -80.37 61.14 4.03 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 127.108 2.163 . . . . 0.0 112.255 -172.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.79 10.91 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -176.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.0 t -76.7 174.11 10.83 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.252 0.621 . . . . 0.0 109.421 166.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 79.5 mt -86.95 125.09 33.82 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.011 -1.055 . . . . 0.0 112.542 -178.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -79.2 166.06 22.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.617 1.167 . . . . 0.0 110.546 169.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.79 -23.3 62.36 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.884 -1.135 . . . . 0.0 113.741 -173.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 98.1 m -65.02 -51.3 62.38 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.024 0.829 . . . . 0.0 110.396 169.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -54.36 -55.52 27.75 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 118.913 0.778 . . . . 0.0 110.489 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.7 mt -54.27 -36.75 63.96 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 33.9 m -77.38 -35.03 54.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.166 0.586 . . . . 0.0 111.852 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -79.44 -23.61 43.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 117.57 -1.205 . . . . 0.0 114.071 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mm -53.09 -47.21 96.61 Favored Pre-proline 0 N--CA 1.483 1.182 0 CA-C-N 120.757 1.617 . . . . 0.0 112.406 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.53 -32.0 12.8 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.663 1.575 . . . . 0.0 113.759 172.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.47 -35.68 80.87 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.877 -1.139 . . . . 0.0 113.171 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.8 m -69.33 -26.39 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.476 0.58 . . . . 0.0 112.341 174.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.08 -51.1 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.334 0.654 . . . . 0.0 110.334 172.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -52.49 -47.86 66.29 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.841 0.856 . . . . 0.0 112.075 173.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -69.5 -23.37 63.61 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.175 -0.953 . . . . 0.0 112.311 -175.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -78.43 -48.23 15.87 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.277 -0.89 . . . . 0.0 112.049 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -27.25 69.04 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.929 1.241 . . . . 0.0 113.646 174.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -70.94 -33.54 70.6 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -128.22 63.19 62.0 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.171 1.388 . . . . 0.0 111.029 -176.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.2 -14.77 20.78 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.142 3.228 . . . . 0.0 116.608 -169.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -89.41 -18.23 27.22 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 -178.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -66.45 158.96 28.16 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.573 1.149 . . . . 0.0 112.033 -176.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.02 130.75 34.88 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 62.2 tp -46.14 -37.03 6.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 114.027 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.409 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.5 m-85 -78.76 -9.78 59.55 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.358 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.7 p -64.77 -24.28 67.51 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 120.603 -1.311 . . . . 0.0 111.671 168.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -73.41 -3.72 29.13 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -78.89 -35.03 44.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.922 1.289 . . . . 0.0 111.558 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -68.34 -32.17 72.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.6 1.16 . . . . 0.0 112.39 -169.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -70.12 -29.24 66.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 115.007 173.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -108.38 -38.52 5.69 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 37.8 m 60.3 -34.88 0.08 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 127.452 2.301 . . . . 0.0 117.085 -170.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' B' ' 109' ' ' HIS . 47.0 t30 65.88 162.35 0.15 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.683 2.793 . . . . 0.0 115.44 -174.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.19 133.76 47.39 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.46 1.104 . . . . 0.0 111.736 171.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 24.3 mt -117.3 115.99 37.63 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.855 1.262 . . . . 0.0 109.765 -177.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -84.07 137.74 7.52 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.493 2.129 . . . . 0.0 113.6 -169.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 . . . . . 0 C--O 1.251 1.172 0 C-N-CA 127.311 2.244 . . . . 0.0 111.637 178.734 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.939 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.5 t30 55.73 52.67 10.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.865 1.666 . . . . 0.0 114.27 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.402 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 28.2 mm-40 -64.61 -17.17 63.75 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 117.855 -1.069 . . . . 0.0 112.654 167.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.5 m 99.24 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 129.645 3.178 . . . . 0.0 115.768 167.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.15 -35.92 72.23 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.997 -1.689 . . . . 0.0 112.339 175.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.463 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -73.13 1.59 8.86 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 173.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -126.22 6.6 7.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.118 1.367 . . . . 0.0 112.126 168.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.45 ' HE2' ' HB2' ' B' ' 98' ' ' LYS . 35.2 ttm -61.61 126.92 29.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.752 -1.217 . . . . 0.0 109.725 172.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.4 t -78.53 154.14 30.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.0 -33.08 74.65 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.8 -1.188 . . . . 0.0 113.132 -174.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -61.88 -32.15 72.49 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -78.62 -38.26 40.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.635 1.174 . . . . 0.0 111.605 175.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -58.13 -50.32 73.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.1 pt -67.5 -7.96 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.48 1.112 . . . . 0.0 113.178 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -105.0 -8.58 18.45 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 125.812 1.645 . . . . 0.0 113.615 175.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.34 159.4 33.4 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 121.065 -1.022 . . . . 0.0 110.738 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -75.93 137.29 69.52 Favored Pre-proline 0 N--CA 1.483 1.199 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -168.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.56 -14.27 41.55 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.159 2.573 . . . . 0.0 116.486 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -63.31 -61.3 2.44 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 125.449 1.5 . . . . 0.0 108.589 166.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.496 ' HB1' HG21 ' B' ' 103' ' ' VAL . . . -81.93 -10.19 59.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.8 ttt -58.63 -35.08 71.92 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.4 m -64.73 -54.56 35.03 Favored Pre-proline 0 N--CA 1.483 1.182 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -176.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.419 ' HG2' HG22 ' B' ' 103' ' ' VAL . 16.4 Cg_endo -54.71 -36.85 91.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.902 2.401 . . . . 0.0 115.739 173.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -38.45 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 119.492 1.042 . . . . 0.0 113.549 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -26.41 67.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.876 0.87 . . . . 0.0 111.151 173.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.517 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 70.7 t90 -87.28 -52.4 5.42 Favored 'General case' 0 C--N 1.343 0.304 0 CA-C-O 117.443 -1.265 . . . . 0.0 112.887 169.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.517 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.5 t90 -67.64 -24.72 65.48 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 121.297 1.862 . . . . 0.0 112.25 -167.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -63.85 -50.16 69.97 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.215 1.006 . . . . 0.0 111.349 169.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.45 -22.34 65.5 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.216 1.406 . . . . 0.0 111.852 -176.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -93.02 -36.53 12.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.224 1.81 . . . . 0.0 113.53 173.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.252 30.5 tt0 53.0 61.65 3.08 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 129.213 3.005 . . . . 0.0 114.621 -176.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . 0.257 13.6 pt-20 46.41 17.49 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 117.975 2.583 . . . . 0.0 117.975 168.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 t -74.9 168.43 19.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.721 1.209 . . . . 0.0 112.578 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.67 132.14 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 C-N-CA 124.554 1.142 . . . . 0.0 110.595 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.99 139.09 30.99 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 125.077 1.351 . . . . 0.0 111.417 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.9 ptpt -145.91 149.13 33.65 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.701 1.201 . . . . 0.0 112.138 -169.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.73 -71.95 0.68 Allowed Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.939 1.257 . . . . 0.0 113.188 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.88 169.75 54.35 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.891 1.234 . . . . 0.0 113.893 174.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -121.56 13.85 10.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.065 1.746 . . . . 0.0 113.788 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.5 p -73.13 24.31 0.06 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.689 2.107 . . . . 0.0 116.689 -169.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -66.94 -0.81 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.76 1.224 . . . . 0.0 112.313 166.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . 0.262 17.1 p -57.59 -23.01 48.49 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 128.625 2.77 . . . . 0.0 114.683 167.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.7 mp 72.72 84.55 0.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 128.931 2.893 . . . . 0.0 109.0 -164.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -66.42 172.89 3.64 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.888 169.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -18.56 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 120.626 -1.296 . . . . 0.0 114.019 -170.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 96.7 m -65.21 -45.26 85.47 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.986 1.266 . . . . 0.0 110.929 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.0 -47.83 83.02 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.7 0.682 . . . . 0.0 110.807 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 54.7 mt -66.04 -28.99 69.27 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.551 -0.718 . . . . 0.0 112.025 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.1 m -74.73 -38.53 62.25 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.795 0.838 . . . . 0.0 111.373 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -79.39 -31.16 42.73 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 117.53 -1.224 . . . . 0.0 113.555 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.5 mp -51.23 -42.16 79.47 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 120.79 1.632 . . . . 0.0 113.305 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -71.76 -38.37 4.3 Favored 'Trans proline' 0 C--N 1.352 0.763 0 CA-C-N 122.138 1.799 . . . . 0.0 113.574 169.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mmtt -67.19 -33.41 75.33 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.084 -1.635 . . . . 0.0 113.801 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.3 m -68.2 -18.5 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.1 mt -87.68 -50.44 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.632 1.173 . . . . 0.0 110.268 172.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -58.56 -36.83 74.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.091 0.957 . . . . 0.0 111.934 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -70.85 -28.72 64.8 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.604 0.638 . . . . 0.0 111.882 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -77.11 -41.52 41.73 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.982 -1.073 . . . . 0.0 112.658 176.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -29.2 67.5 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 120.71 1.595 . . . . 0.0 113.973 177.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -81.48 -27.5 34.54 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 173.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -130.8 70.84 82.58 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.625 1.57 . . . . 0.0 110.754 173.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.92 -11.99 13.85 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 124.858 3.705 . . . . 0.0 116.368 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -84.63 -21.45 30.28 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.359 1.464 . . . . 0.0 113.292 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -67.9 156.34 37.41 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.669 0.787 . . . . 0.0 111.996 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -89.06 131.72 35.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.4 -38.42 28.85 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -169.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.26 5.4 m-85 -78.46 -8.3 58.37 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.369 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.7 p -61.01 -23.54 65.48 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.416 -1.427 . . . . 0.0 111.633 167.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.82 -10.72 59.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.699 -1.25 . . . . 0.0 112.568 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -31.78 71.44 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.725 1.148 . . . . 0.0 111.185 168.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.42 -13.44 62.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.642 1.177 . . . . 0.0 112.312 -173.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -82.87 -29.85 29.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.398 2.279 . . . . 0.0 114.689 173.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -107.97 122.92 47.83 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -164.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.6 p -85.78 -41.84 14.72 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 170.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 56.77 -172.07 0.08 Allowed 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 126.395 1.878 . . . . 0.0 113.175 -170.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -81.37 -27.19 34.97 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -166.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.544 ' H ' HD23 ' A' ' 77' ' ' LEU . 2.1 pt? -60.55 147.88 82.28 Favored Pre-proline 0 CA--C 1.546 0.813 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -178.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -77.41 162.21 31.0 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.011 2.474 . . . . 0.0 110.508 167.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 t30 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 124.843 1.257 . . . . 0.0 112.297 177.794 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.902 0 CA-C-O 121.011 0.434 . . . . 0.0 112.05 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.4 44.16 15.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.879 1.672 . . . . 0.0 115.044 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -64.41 -22.37 66.94 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.348 0.659 . . . . 0.0 111.618 167.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.2 t 94.44 104.52 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.407 3.083 . . . . 0.0 116.231 168.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.64 74.89 Favored 'General case' 0 CA--C 1.551 0.996 0 O-C-N 120.711 -1.243 . . . . 0.0 111.191 169.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.465 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 23.4 mtmt -62.61 -28.03 69.61 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.416 1.486 . . . . 0.0 114.178 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -105.91 8.23 32.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.634 1.173 . . . . 0.0 113.478 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 49.2 ttm -63.91 130.34 43.69 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.644 -1.285 . . . . 0.0 110.392 173.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.2 t -79.32 156.28 28.1 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.01 -1.056 . . . . 0.0 110.814 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.25 -32.67 71.37 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.079 -1.638 . . . . 0.0 112.884 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -63.3 -32.13 73.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -74.96 -40.4 60.78 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.646 0.779 . . . . 0.0 111.938 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -60.34 -46.02 91.41 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.221 0.464 . . . . 0.0 111.892 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -72.21 -10.44 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.614 175.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.45 -20.25 20.48 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 170.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 156.0 37.15 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.029 0.932 . . . . 0.0 112.285 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.436 HD21 ' HD2' ' B' ' 98' ' ' LYS . 1.1 t-20 -56.11 135.45 74.44 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.631 1.172 . . . . 0.0 113.203 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 13.6 Cg_exo -75.39 -5.87 17.12 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.419 1.413 . . . . 0.0 115.474 -178.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.45 ' HB2' ' HE2' ' A' ' 8' ' ' MET . 12.8 mttt -70.68 -59.74 2.65 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.48 1.491 . . . . 0.0 109.509 167.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 99' ' ' ALA . . . . . 0.437 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -81.55 -11.38 59.18 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -177.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 23.8 ttm -53.98 -31.09 49.66 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.611 -1.306 . . . . 0.0 112.92 171.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 36.3 m -68.44 -57.36 8.73 Favored Pre-proline 0 N--CA 1.484 1.254 0 CA-C-O 117.998 -1.001 . . . . 0.0 112.751 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.03 -36.27 75.43 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.83 3.02 . . . . 0.0 114.096 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.496 HG21 ' HB1' ' A' ' 20' ' ' ALA . 60.7 t -64.12 -52.17 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 121.469 -0.769 . . . . 0.0 111.395 175.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.42 -36.36 80.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.636 1.175 . . . . 0.0 111.372 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.513 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.7 t90 -71.31 -51.12 26.12 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 117.054 -1.45 . . . . 0.0 113.088 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.447 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.91 -27.68 67.69 Favored 'General case' 0 C--N 1.349 0.582 0 C-N-CA 116.911 -1.916 . . . . 0.0 111.139 -169.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.6 tmm? -60.59 -42.1 96.05 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.082 0.953 . . . . 0.0 112.217 169.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -24.4 63.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.046 1.338 . . . . 0.0 114.395 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -109.28 -20.2 13.03 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 62.16 158.28 0.06 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.641 2.776 . . . . 0.0 116.881 -172.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -75.56 -3.27 33.26 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.931 1.692 . . . . 0.0 112.639 171.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 58.6 p -66.6 154.88 39.34 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.011 1.324 . . . . 0.0 112.083 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.6 p -88.33 147.01 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.515 0.726 . . . . 0.0 112.681 -169.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -75.8 159.76 30.69 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.429 1.091 . . . . 0.0 112.824 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 10.2 ptpt -140.02 23.75 2.39 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -168.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 172.48 -55.48 0.17 Allowed Glycine 0 CA--C 1.534 1.224 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 170.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -81.37 178.38 53.89 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 123.722 0.677 . . . . 0.0 114.711 -174.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -65.21 139.03 58.61 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.92 0.888 . . . . 0.0 109.226 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.05 153.06 23.16 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -166.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . 0.306 33.0 m 52.88 19.67 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 128.719 2.808 . . . . 0.0 117.384 171.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -30.99 69.97 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . 0.411 0.3 OUTLIER 61.18 161.2 0.06 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.697 2.399 . . . . 0.0 114.658 -167.059 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -130.13 169.28 15.54 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.854 1.662 . . . . 0.0 111.857 -167.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.2 -26.23 68.7 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.704 -1.247 . . . . 0.0 112.238 171.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 91.1 m -60.77 -43.53 97.92 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.878 0.871 . . . . 0.0 110.72 169.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -65.18 -48.57 73.0 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.748 -0.595 . . . . 0.0 110.25 175.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.47 -29.96 62.35 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 42.5 m -81.07 -36.39 30.53 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.092 0.957 . . . . 0.0 112.187 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -80.24 -30.06 38.48 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.055 -1.028 . . . . 0.0 113.723 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.84 -41.4 84.53 Favored Pre-proline 0 CA--C 1.552 1.052 0 CA-C-N 120.351 1.432 . . . . 0.0 113.629 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -73.29 -37.32 3.39 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 CA-C-N 122.477 1.92 . . . . 0.0 113.468 169.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -67.65 -28.84 68.05 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 120.338 -1.477 . . . . 0.0 114.232 -175.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.25 -26.72 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 118.59 0.632 . . . . 0.0 112.076 173.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 43.6 mt -70.24 -51.27 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 123.927 0.891 . . . . 0.0 109.438 171.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -53.21 -48.85 67.8 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.79 0.836 . . . . 0.0 112.033 173.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -70.09 -25.1 63.36 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.124 -0.985 . . . . 0.0 112.075 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.34 -46.2 28.65 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.635 0.774 . . . . 0.0 112.177 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -26.69 67.36 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 120.389 1.45 . . . . 0.0 113.622 173.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttm -70.28 -31.58 69.0 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 168.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -133.18 65.25 72.77 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 125.046 1.338 . . . . 0.0 112.381 -179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -58.82 -15.29 25.93 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.094 2.529 . . . . 0.0 116.732 -171.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -83.7 -16.42 45.0 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.922 1.289 . . . . 0.0 113.603 -177.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -72.87 153.8 40.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.953 0.901 . . . . 0.0 111.375 -172.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -85.62 132.82 34.1 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.5 tp -51.52 -36.16 43.68 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 6.1 m-85 -81.76 -6.47 59.08 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.3 p -61.19 -27.55 68.5 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 120.524 -1.36 . . . . 0.0 111.317 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.37 -4.02 23.95 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.472 1.509 . . . . 0.0 114.317 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -29.46 37.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.97 1.308 . . . . 0.0 112.021 167.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.26 -32.31 64.62 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.646 1.178 . . . . 0.0 112.2 -171.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.36 -28.6 67.26 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.697 1.599 . . . . 0.0 114.864 173.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -82.04 -36.08 28.11 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -166.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.7 m 44.97 53.23 7.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.845 1.258 . . . . 0.0 112.466 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.26 165.98 6.79 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.973 1.309 . . . . 0.0 112.651 -172.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -62.47 127.63 32.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -172.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -157.02 161.9 28.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 126.928 2.091 . . . . 0.0 111.374 173.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -59.98 151.49 71.54 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.354 2.702 . . . . 0.0 114.042 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.6 m120 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 124.991 1.316 . . . . 0.0 112.704 177.013 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 121.625 0.726 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.333 0.2 OUTLIER 68.45 33.91 3.89 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.212 1.805 . . . . 0.0 115.289 173.271 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -73.04 163.47 28.11 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 126.041 1.736 . . . . 0.0 106.438 162.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.8 t -102.57 103.44 13.77 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.367 1.467 . . . . 0.0 113.091 -164.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.99 70.52 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.434 -1.416 . . . . 0.0 110.748 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.471 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.0 ptpt -74.1 -4.69 37.14 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -125.83 12.29 7.87 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.151 1.381 . . . . 0.0 112.139 168.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.0 ttm -60.6 122.44 14.72 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.623 -1.298 . . . . 0.0 108.544 170.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.9 t -75.96 154.64 35.72 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.867 -1.146 . . . . 0.0 110.421 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.66 -30.94 71.97 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.267 -1.521 . . . . 0.0 113.342 -172.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -40.72 97.52 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.017 0.826 . . . . 0.0 111.928 170.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.69 -37.36 82.2 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.199 1.0 . . . . 0.0 111.568 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.65 -51.86 67.62 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.563 0.745 . . . . 0.0 112.353 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -69.43 -1.77 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 124.554 1.142 . . . . 0.0 112.737 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -106.59 -7.58 17.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.483 1.513 . . . . 0.0 113.587 171.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.14 160.71 29.48 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.021 -1.049 . . . . 0.0 111.135 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.444 HD21 ' HD3' ' A' ' 19' ' ' LYS . 46.2 t-20 -66.0 128.76 94.04 Favored Pre-proline 0 N--CA 1.484 1.273 0 O-C-N 121.024 -1.047 . . . . 0.0 111.528 -175.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.6 -21.02 23.11 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 124.094 3.196 . . . . 0.0 115.607 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.8 mptt -57.89 -68.07 0.28 Allowed 'General case' 0 C--N 1.351 0.639 0 C-N-CA 126.117 1.767 . . . . 0.0 109.539 168.397 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.423 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -78.17 -7.9 57.64 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 10.9 ttt -62.84 -35.86 81.33 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.291 -1.505 . . . . 0.0 113.206 170.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.4 m -60.43 -53.66 62.53 Favored Pre-proline 0 N--CA 1.485 1.311 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.409 ' HA ' ' CE2' ' B' ' 106' ' ' TRP . 2.7 Cg_endo -49.31 -47.12 23.38 Favored 'Trans proline' 0 CA--C 1.51 -0.694 0 C-N-CA 123.389 2.726 . . . . 0.0 114.133 167.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 20' ' ' ALA . 57.2 t -57.88 -32.94 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.807 0.443 . . . . 0.0 111.793 -178.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.96 -27.42 65.71 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.385 1.074 . . . . 0.0 113.579 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.415 ' CB ' ' CH2' ' B' ' 106' ' ' TRP . 52.4 t90 -88.14 -39.38 14.58 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.81 1.186 . . . . 0.0 109.993 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.537 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 3.6 m95 -62.76 -35.08 78.67 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -167.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -72.85 -47.61 44.65 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.257 1.423 . . . . 0.0 112.787 168.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -73.99 -28.71 61.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.829 1.251 . . . . 0.0 114.12 -168.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -116.6 -5.76 11.65 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.015 1.326 . . . . 0.0 114.365 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 61.99 168.48 0.11 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 127.444 2.298 . . . . 0.0 116.69 175.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.94 0.03 12.34 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 125.972 1.709 . . . . 0.0 114.422 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.8 t -75.95 -179.34 4.82 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.54 1.936 . . . . 0.0 113.978 -176.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 p -110.78 146.31 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.445 1.498 . . . . 0.0 112.297 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -71.18 161.7 30.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.888 1.275 . . . . 0.0 113.479 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmpt? -78.62 -18.77 54.0 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -169.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -171.62 -22.27 0.02 OUTLIER Glycine 0 CA--C 1.534 1.261 0 N-CA-C 116.263 1.265 . . . . 0.0 116.263 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.38 -172.89 33.82 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 118.934 1.367 . . . . 0.0 114.586 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -132.41 11.77 4.52 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.79 1.636 . . . . 0.0 114.17 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.6 m -76.95 72.17 3.5 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.882 1.273 . . . . 0.0 112.159 -170.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.7 m -64.23 -11.46 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.789 1.235 . . . . 0.0 114.033 177.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.99 145.43 10.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.711 2.004 . . . . 0.0 113.154 175.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 38.2 mt -69.96 117.08 11.08 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.232 0.613 . . . . 0.0 109.703 172.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -80.44 170.85 15.82 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.841 1.256 . . . . 0.0 109.761 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -65.53 -24.93 67.24 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.855 -1.778 . . . . 0.0 112.531 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.7 m -65.84 -46.32 78.97 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.414 -0.804 . . . . 0.0 110.833 168.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -58.61 -48.47 80.86 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.898 0.772 . . . . 0.0 110.245 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.49 -25.15 68.13 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.141 -0.975 . . . . 0.0 112.439 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.0 m -78.54 -37.98 41.56 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.592 0.757 . . . . 0.0 111.467 171.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -81.7 -30.85 32.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.974 -1.012 . . . . 0.0 113.148 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.04 -41.68 75.56 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-O 117.232 -1.366 . . . . 0.0 113.008 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.95 -37.85 2.59 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 122.336 1.87 . . . . 0.0 113.807 168.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -67.82 -33.41 74.74 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.032 -1.667 . . . . 0.0 113.633 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 19.1 m -68.32 -13.95 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.4 mt -92.09 -51.09 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.635 1.174 . . . . 0.0 110.578 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.89 -35.52 73.15 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.974 0.909 . . . . 0.0 111.771 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -68.53 -29.62 68.24 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 122.078 -0.389 . . . . 0.0 111.915 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.27 -45.7 31.44 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.838 -1.164 . . . . 0.0 112.745 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.54 68.79 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.644 1.566 . . . . 0.0 113.977 177.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -77.06 -32.82 57.14 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -133.2 77.22 67.4 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 124.639 1.176 . . . . 0.0 112.094 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.55 -9.96 3.13 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 124.772 3.648 . . . . 0.0 117.024 175.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.39 -25.57 51.0 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.045 1.338 . . . . 0.0 112.511 -177.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -67.13 153.59 43.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.926 1.291 . . . . 0.0 111.448 -172.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -87.38 131.61 34.23 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 169.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -51.72 -36.72 47.99 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -169.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.471 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.0 m-85 -79.57 -6.85 57.9 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 58.8 p -59.79 -26.7 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.458 -1.401 . . . . 0.0 111.053 167.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -71.84 -3.1 20.35 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.754 1.622 . . . . 0.0 114.143 177.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -31.65 25.5 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.976 1.31 . . . . 0.0 111.693 169.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.3 -26.19 64.61 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.27 1.028 . . . . 0.0 112.151 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -74.85 -29.51 61.07 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.563 1.545 . . . . 0.0 114.929 171.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.85 111.72 24.02 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.04 1.336 . . . . 0.0 114.604 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.8 p -74.65 -31.01 61.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.148 0.979 . . . . 0.0 112.433 168.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 47.9 t30 50.19 -143.27 0.59 Allowed 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 126.76 2.024 . . . . 0.0 113.285 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -139.93 119.96 13.63 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.309 1.443 . . . . 0.0 111.133 173.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.2 mp -105.55 120.67 48.62 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.339 1.056 . . . . 0.0 110.188 -178.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_exo -57.57 123.64 14.23 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.584 2.856 . . . . 0.0 113.567 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.4 p30 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.229 1.812 . . . . 0.0 112.531 -172.846 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.0 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.282 10.7 t-20 63.5 35.21 12.09 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.109 1.433 . . . . 0.0 114.313 177.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.04 159.13 34.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.142 1.777 . . . . 0.0 106.8 164.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 15.6 t -93.94 97.56 10.44 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -166.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.74 -33.25 64.11 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 120.944 -1.098 . . . . 0.0 111.091 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -64.41 -31.33 72.49 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.537 1.935 . . . . 0.0 114.608 177.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -114.26 13.9 17.98 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.925 1.29 . . . . 0.0 113.132 -177.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.0 ttm -58.77 122.31 13.25 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.919 -1.113 . . . . 0.0 108.888 169.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.6 t -77.46 156.84 30.81 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.876 -1.14 . . . . 0.0 110.682 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.04 -34.06 76.76 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.142 -1.598 . . . . 0.0 112.909 -173.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -65.1 -31.45 72.66 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.192 0.906 . . . . 0.0 112.595 173.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -77.63 -37.08 50.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.784 1.234 . . . . 0.0 111.35 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -62.51 -49.42 75.44 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.331 -0.856 . . . . 0.0 112.28 176.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.05 -7.61 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.683 0.793 . . . . 0.0 112.971 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -100.88 -13.91 18.16 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.936 1.694 . . . . 0.0 113.877 171.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.34 158.42 35.11 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.454 1.025 . . . . 0.0 111.114 173.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -62.33 133.91 94.62 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.894 0.878 . . . . 0.0 112.815 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.43 -13.88 33.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.789 2.326 . . . . 0.0 116.042 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -66.38 -50.41 63.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 121.151 1.796 . . . . 0.0 107.929 168.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -87.98 -5.18 58.66 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 25.0 mtt -55.46 -44.48 76.44 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.652 -1.28 . . . . 0.0 111.98 169.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 89.4 m -61.17 -52.62 70.16 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 124.666 1.186 . . . . 0.0 113.088 -175.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' PRO . . . . . 0.428 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 11.6 Cg_endo -52.97 -49.75 16.48 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 124.047 3.165 . . . . 0.0 114.983 171.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.06 -37.05 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.672 -1.268 . . . . 0.0 112.867 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.38 -29.8 70.74 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.593 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.537 ' CD2' ' CZ2' ' A' ' 27' ' ' TRP . 73.2 t90 -81.81 -46.42 14.2 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.191 1.359 . . . . 0.0 112.452 173.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.415 ' CH2' ' CB ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -41.02 -38.55 1.01 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.703 0.801 . . . . 0.0 111.962 169.485 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 57.5 ttp -75.08 -64.58 1.02 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.409 1.484 . . . . 0.0 113.849 169.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.39 -31.06 65.42 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -170.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -125.64 21.66 7.7 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -171.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 58.53 93.75 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 116.759 2.133 . . . . 0.0 116.759 169.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 13.7 tm-20 -57.78 -27.71 63.34 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.299 -0.876 . . . . 0.0 111.686 166.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 18.7 p -71.41 39.18 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.878 2.871 . . . . 0.0 114.841 -177.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . 0.287 0.5 OUTLIER 71.31 152.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 128.184 2.594 . . . . 0.0 115.634 178.357 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -101.63 176.8 5.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.623 1.569 . . . . 0.0 113.373 -170.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt -147.91 163.77 35.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.685 1.594 . . . . 0.0 112.001 -174.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.41 -105.06 1.33 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 123.763 0.696 . . . . 0.0 113.126 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -165.89 150.78 18.67 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.042 0.829 . . . . 0.0 113.861 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.309 4.7 p-10 38.28 -127.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.772 2.029 . . . . 0.0 114.269 -175.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . 0.25 41.5 p 47.8 -0.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 28.5 m -63.53 -2.74 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 127.006 2.123 . . . . 0.0 114.501 172.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.8 159.65 5.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.394 1.478 . . . . 0.0 112.1 169.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 66.0 tp -76.97 120.95 22.8 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 165.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -103.53 164.62 11.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.306 1.042 . . . . 0.0 112.536 -169.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.51 -26.67 67.27 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.286 -1.509 . . . . 0.0 112.586 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.6 m -62.99 -45.4 92.58 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.507 -0.746 . . . . 0.0 110.919 169.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.32 -55.57 33.06 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.712 0.687 . . . . 0.0 109.473 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.2 mt -54.57 -33.67 60.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.145 0.978 . . . . 0.0 112.881 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 51.9 m -77.51 -35.2 53.74 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.664 0.786 . . . . 0.0 111.92 175.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -81.22 -23.46 38.09 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.94 -47.05 96.87 Favored Pre-proline 0 N--CA 1.482 1.126 0 CA-C-N 120.305 1.411 . . . . 0.0 112.338 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.3 -34.95 14.98 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 122.065 1.773 . . . . 0.0 113.612 172.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -66.0 -32.06 73.33 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.625 -1.297 . . . . 0.0 113.539 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.91 -28.31 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 61.5 mt -69.55 -49.53 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.883 0.873 . . . . 0.0 109.8 172.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.39 -53.52 56.41 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.712 0.805 . . . . 0.0 111.208 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -62.56 -26.41 68.56 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.073 -1.017 . . . . 0.0 113.068 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.75 -48.01 17.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.187 0.903 . . . . 0.0 112.561 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -25.2 67.1 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 121.059 1.754 . . . . 0.0 113.653 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -73.45 -28.02 61.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.725 1.61 . . . . 0.0 114.478 168.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -135.01 63.65 58.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.122 1.369 . . . . 0.0 110.735 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -63.82 -12.42 31.6 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.403 2.735 . . . . 0.0 115.871 -168.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.16 -17.01 38.5 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.348 1.459 . . . . 0.0 113.447 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -74.32 161.38 29.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.536 1.135 . . . . 0.0 111.985 -173.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -75.02 159.99 31.08 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.68 -0.638 . . . . 0.0 109.772 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.9 tp -70.8 -62.91 1.22 Allowed 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.586 -0.696 . . . . 0.0 112.257 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -61.52 -24.0 66.31 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 -167.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.7 t -57.46 -23.68 51.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.742 -0.599 . . . . 0.0 112.066 172.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -63.85 -3.46 2.46 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 119.789 -1.819 . . . . 0.0 114.5 174.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -35.38 63.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.235 1.379 . . . . 0.0 111.396 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -33.56 75.89 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -167.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -67.53 -27.22 66.79 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.541 1.937 . . . . 0.0 115.053 172.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -101.43 106.27 17.38 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.102 1.361 . . . . 0.0 113.845 -167.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 50.8 m -77.59 73.12 4.16 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.241 1.016 . . . . 0.0 110.258 169.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -69.54 172.54 7.16 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.698 1.199 . . . . 0.0 112.591 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -77.13 49.64 0.69 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.009 1.723 . . . . 0.0 114.259 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.12 152.64 44.52 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.546 2.338 . . . . 0.0 111.208 172.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.64 161.29 37.09 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.055 2.503 . . . . 0.0 112.852 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.342 0 C-N-CA 125.659 1.584 . . . . 0.0 111.092 178.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.09 0 CA-C-O 121.226 0.536 . . . . 0.0 112.327 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.264 45.8 t30 60.34 42.6 14.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.101 1.76 . . . . 0.0 115.041 175.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.404 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 23.3 mm-40 -59.31 -26.12 64.73 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.724 0.81 . . . . 0.0 111.475 166.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t 97.78 106.52 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 129.647 3.179 . . . . 0.0 114.682 168.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.49 -31.0 70.97 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.708 -1.245 . . . . 0.0 111.347 170.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.449 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 9.1 mtmt -63.65 -25.08 68.05 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.449 1.5 . . . . 0.0 114.366 175.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.09 5.85 28.33 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.829 1.252 . . . . 0.0 113.356 175.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 41.4 ttm -62.03 125.31 23.43 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.656 -1.277 . . . . 0.0 109.922 173.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -78.57 155.92 29.42 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.842 -1.161 . . . . 0.0 110.187 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.63 -35.71 78.66 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.588 -1.32 . . . . 0.0 112.84 -174.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -61.69 -35.03 76.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 172.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -77.09 -37.38 54.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.653 1.181 . . . . 0.0 111.342 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -60.49 -49.91 75.65 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.619 -0.675 . . . . 0.0 112.378 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.5 pt -69.49 -1.68 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 124.394 1.078 . . . . 0.0 112.663 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -110.0 -12.27 14.55 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.522 1.529 . . . . 0.0 113.897 174.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.25 163.08 25.81 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 121.02 -1.05 . . . . 0.0 110.5 169.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.481 HD21 ' HD3' ' A' ' 19' ' ' LYS . 47.4 t-20 -66.1 131.18 94.42 Favored Pre-proline 0 N--CA 1.483 1.192 0 O-C-N 120.745 -1.222 . . . . 0.0 112.05 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 30.6 Cg_exo -61.39 -16.3 46.37 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.459 2.772 . . . . 0.0 115.415 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HD3' HD21 ' A' ' 17' ' ' ASN . 5.1 mptt -56.93 -61.74 2.23 Favored 'General case' 0 C--N 1.35 0.61 0 C-N-CA 125.983 1.713 . . . . 0.0 108.814 168.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.452 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -82.44 -7.74 59.63 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 86.5 mtp -58.86 -37.0 75.52 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 120.403 1.456 . . . . 0.0 112.859 171.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.9 m -62.04 -55.96 36.06 Favored Pre-proline 0 N--CA 1.486 1.344 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -56.21 -39.05 93.72 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.265 2.643 . . . . 0.0 112.885 169.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 20' ' ' ALA . 99.1 t -60.39 -42.84 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 120.033 -1.667 . . . . 0.0 111.969 175.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.34 -41.98 79.97 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.082 0.953 . . . . 0.0 110.962 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HB3' ' CH2' ' B' ' 106' ' ' TRP 0.267 0.0 OUTLIER -73.34 -41.58 63.3 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 115.974 -1.965 . . . . 0.0 111.404 177.029 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.484 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 0.3 OUTLIER -65.58 -25.22 67.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.644 2.474 . . . . 0.0 113.85 175.851 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -67.04 -45.52 77.17 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.808 -0.557 . . . . 0.0 111.144 168.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.52 -35.14 73.02 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 113.734 -177.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -133.68 102.51 5.5 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.446 2.298 . . . . 0.0 108.049 172.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.438 ' C ' ' H ' ' A' ' 33' ' ' THR . 49.0 mt-10 -67.24 -178.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.916 1.287 . . . . 0.0 113.375 -174.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -66.51 18.11 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 125.364 1.465 . . . . 0.0 113.073 167.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.438 ' H ' ' C ' ' A' ' 31' ' ' GLU . 13.1 t -74.48 156.45 36.91 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.399 2.28 . . . . 0.0 112.462 173.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 84.0 t -81.0 133.44 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.394 1.078 . . . . 0.0 109.862 176.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -66.04 22.97 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 129.198 2.999 . . . . 0.0 118.126 -169.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt 60.83 15.28 5.82 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 126.196 1.798 . . . . 0.0 115.605 171.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.95 1.87 72.49 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.388 1.47 . . . . 0.0 115.085 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.17 179.41 48.0 Favored Glycine 0 CA--C 1.539 1.592 0 CA-C-N 118.636 1.218 . . . . 0.0 112.813 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -75.84 119.75 20.25 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.657 -0.908 . . . . 0.0 110.617 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.4 m -68.11 138.66 55.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.942 0.897 . . . . 0.0 112.447 -169.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . 0.3 11.0 m 56.26 4.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 128.969 2.908 . . . . 0.0 118.025 -176.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 154.41 41.25 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.227 1.376 . . . . 0.0 112.79 171.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -147.73 169.29 20.03 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.201 1.4 . . . . 0.0 112.475 -179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -133.04 174.63 10.15 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.868 2.067 . . . . 0.0 110.889 -169.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -63.15 -24.58 67.96 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.805 -1.185 . . . . 0.0 112.433 171.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.3 m -58.64 -47.47 84.3 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.503 -0.748 . . . . 0.0 110.985 168.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -61.86 -44.11 97.49 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.414 -0.804 . . . . 0.0 110.062 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 68.3 mt -64.57 -19.24 65.53 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.143 0.977 . . . . 0.0 112.954 175.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.5 m -89.15 -27.63 20.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.529 1.932 . . . . 0.0 112.323 173.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -83.45 -33.98 25.54 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 120.814 -1.178 . . . . 0.0 111.823 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.52 -42.76 89.76 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-O 117.227 -1.368 . . . . 0.0 113.535 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.13 -39.77 7.25 Favored 'Trans proline' 0 C--N 1.35 0.654 0 CA-C-N 122.571 1.954 . . . . 0.0 112.845 169.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -62.94 -38.81 92.53 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.625 1.557 . . . . 0.0 113.461 -176.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.0 m -70.41 -19.54 22.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.372 0.669 . . . . 0.0 112.491 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.8 mt -81.36 -47.99 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.316 -0.865 . . . . 0.0 109.933 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.84 -37.22 78.64 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.101 0.96 . . . . 0.0 112.008 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -68.62 -26.23 65.25 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.695 0.679 . . . . 0.0 111.758 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.0 m -77.65 -46.74 21.11 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.234 -0.916 . . . . 0.0 112.89 174.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -29.17 67.95 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 120.799 1.636 . . . . 0.0 114.166 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.66 -27.76 55.72 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -135.16 74.31 62.59 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.996 1.318 . . . . 0.0 112.073 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -59.03 -9.66 8.39 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 124.36 3.373 . . . . 0.0 117.371 -177.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -82.21 -22.11 36.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.981 1.312 . . . . 0.0 113.139 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? -68.9 157.7 36.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.3 1.04 . . . . 0.0 111.7 -174.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -75.86 152.39 37.21 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 169.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.5 -39.92 81.1 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.015 -1.053 . . . . 0.0 113.087 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.449 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.2 m-85 -86.68 -19.28 29.46 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -58.97 -23.46 61.7 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.318 -0.864 . . . . 0.0 111.671 170.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -58.19 -15.81 11.27 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.761 -1.837 . . . . 0.0 112.902 171.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.3 tptt -58.58 -35.28 72.15 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.045 -1.034 . . . . 0.0 112.597 168.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.16 -26.03 67.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.714 0.806 . . . . 0.0 112.208 -169.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -68.48 -30.21 69.0 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.894 2.078 . . . . 0.0 114.233 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -112.78 106.96 15.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -165.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.0 p -107.49 2.18 24.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.61 1.564 . . . . 0.0 114.894 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -63.04 159.37 17.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -169.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.5 t70 67.27 -40.69 0.4 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 128.678 2.791 . . . . 0.0 116.177 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.4 mt -68.21 128.46 93.2 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 124.678 1.191 . . . . 0.0 111.35 -177.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.85 167.2 27.61 Favored 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.063 2.509 . . . . 0.0 112.532 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.354 0 C-N-CA 125.932 1.693 . . . . 0.0 113.213 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.303 0.3 OUTLIER 66.97 36.03 4.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.303 1.441 . . . . 0.0 114.622 172.774 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -75.06 160.54 30.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.215 1.806 . . . . 0.0 106.201 163.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.2 t -97.84 98.36 9.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 120.948 -1.095 . . . . 0.0 113.89 -166.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.52 62.79 Favored 'General case' 0 CA--C 1.555 1.164 0 O-C-N 120.771 -1.205 . . . . 0.0 110.815 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt -59.7 -30.78 69.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.988 2.115 . . . . 0.0 115.03 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -117.52 12.69 14.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.837 1.255 . . . . 0.0 113.107 -175.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 54.4 ttm -60.88 119.7 8.74 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.002 -1.061 . . . . 0.0 108.949 169.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -75.95 156.42 34.19 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.115 -0.99 . . . . 0.0 110.422 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -33.19 73.86 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.486 -1.384 . . . . 0.0 112.957 -172.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -65.75 -32.87 74.66 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.153 0.888 . . . . 0.0 112.865 173.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -77.41 -35.6 54.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.274 1.43 . . . . 0.0 111.17 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.51 -51.36 65.83 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.307 1.043 . . . . 0.0 112.411 175.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.9 pt -68.01 -4.03 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -103.01 -11.25 18.3 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.088 1.755 . . . . 0.0 114.182 170.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.17 157.61 37.31 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.983 1.265 . . . . 0.0 110.748 171.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.413 HD21 ' HD3' ' B' ' 98' ' ' LYS 0.262 0.1 OUTLIER -73.37 146.51 86.61 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -169.66 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -71.84 -10.55 26.51 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.865 1.71 . . . . 0.0 114.717 -177.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.413 ' HD3' HD21 ' B' ' 96' ' ' ASN . 5.8 mptt -67.81 -55.44 12.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.876 1.216 . . . . 0.0 108.572 167.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.65 -13.96 52.98 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.9 mmt -47.69 -43.43 26.55 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.742 1.156 . . . . 0.0 112.581 171.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -61.3 -55.31 44.77 Favored Pre-proline 0 N--CA 1.481 1.111 0 C-N-CA 124.535 1.134 . . . . 0.0 113.606 -171.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' PRO . . . . . 0.402 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 14.0 Cg_endo -54.7 -47.4 26.92 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.471 2.781 . . . . 0.0 114.513 171.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.7 p -70.17 -34.54 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 120.574 -1.329 . . . . 0.0 113.095 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.61 -25.21 67.28 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.671 0.788 . . . . 0.0 111.746 173.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.484 ' CG ' ' CZ2' ' A' ' 27' ' ' TRP . 62.6 t90 -80.78 -50.27 10.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.436 1.017 . . . . 0.0 111.254 168.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CH2' ' HB3' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -50.45 -44.37 55.47 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 121.696 0.76 . . . . 0.0 112.258 -172.724 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -64.47 -45.36 87.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.317 1.047 . . . . 0.0 112.045 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.83 -29.67 58.71 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.072 1.349 . . . . 0.0 113.012 -171.11 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -126.75 -17.66 4.93 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 116.398 1.999 . . . . 0.0 116.398 -173.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 65.39 156.4 0.09 Allowed 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 174.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -88.89 5.55 43.38 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.571 1.548 . . . . 0.0 113.836 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 15.8 p -63.12 137.58 58.28 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.403 -0.811 . . . . 0.0 110.389 169.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 4.4 p -64.89 139.35 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -76.7 160.02 29.69 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.131 0.972 . . . . 0.0 111.701 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.27 62.82 0.61 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.582 1.553 . . . . 0.0 112.063 -178.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 87.38 6.2 78.19 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 125.581 1.562 . . . . 0.0 115.52 -177.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -88.64 162.9 32.0 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.603 1.097 . . . . 0.0 114.019 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -135.09 19.78 3.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.605 1.562 . . . . 0.0 113.499 -177.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 47.5 p -71.09 7.1 1.32 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.255 1.946 . . . . 0.0 116.255 -168.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 9.1 m -58.82 -15.31 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 125.596 1.558 . . . . 0.0 112.636 167.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 11.9 p -50.0 -25.62 3.52 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.943 2.097 . . . . 0.0 114.618 168.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 53.2 mt 68.07 79.51 0.22 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 127.665 2.386 . . . . 0.0 111.219 -169.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -60.57 165.68 3.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.912 169.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.87 -23.51 65.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -172.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.2 m -68.05 -47.76 67.48 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.117 0.871 . . . . 0.0 110.618 171.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.91 -49.77 76.55 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.454 1.025 . . . . 0.0 111.65 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -32.64 67.51 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 59.3 m -78.57 -36.04 45.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.701 0.8 . . . . 0.0 111.796 175.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -81.42 -32.96 32.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 117.428 -1.273 . . . . 0.0 114.421 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -48.11 -47.92 64.75 Favored Pre-proline 0 N--CA 1.482 1.157 0 CA-C-N 120.667 1.576 . . . . 0.0 113.175 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.92 -32.26 29.29 Favored 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 122.116 1.791 . . . . 0.0 113.811 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -65.2 -30.78 71.71 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.584 -1.322 . . . . 0.0 113.456 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.55 -31.76 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.285 0.493 . . . . 0.0 111.267 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -71.84 -50.77 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.564 1.146 . . . . 0.0 109.847 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.85 -39.96 82.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.414 0.686 . . . . 0.0 112.453 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -71.43 -27.44 63.29 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 118.828 0.74 . . . . 0.0 112.725 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -73.84 -47.99 34.44 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.403 -0.811 . . . . 0.0 112.478 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -26.79 67.82 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 120.359 1.436 . . . . 0.0 114.832 -178.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -80.67 -16.93 52.75 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -137.78 65.34 45.91 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 125.425 1.49 . . . . 0.0 111.463 174.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -64.12 -11.59 28.33 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.856 3.037 . . . . 0.0 115.923 -169.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -83.99 -17.1 41.62 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.014 1.325 . . . . 0.0 113.328 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -74.01 158.95 33.39 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.615 1.166 . . . . 0.0 111.545 -174.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.63 154.05 27.61 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.674 -0.641 . . . . 0.0 110.094 172.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -66.3 -44.9 82.18 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.24 -0.913 . . . . 0.0 113.044 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -77.55 -19.77 55.19 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -169.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 12.6 t -64.45 -16.4 62.36 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.738 -1.226 . . . . 0.0 112.412 169.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -67.56 -2.97 7.47 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.348 -2.095 . . . . 0.0 113.499 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -27.95 35.71 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.28 1.432 . . . . 0.0 112.293 167.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -64.36 -35.44 80.89 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.899 1.28 . . . . 0.0 112.049 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -72.1 -28.35 63.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.445 1.898 . . . . 0.0 115.403 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -104.55 102.14 11.77 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -166.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 55.8 m -84.21 79.18 9.62 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.688 1.195 . . . . 0.0 109.558 168.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -73.24 170.43 15.01 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -169.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -71.38 91.63 1.02 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.63 1.572 . . . . 0.0 113.904 -173.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -141.89 161.11 53.15 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.119 2.168 . . . . 0.0 110.563 170.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -58.88 130.33 36.26 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.078 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 6.8 p30 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.791 1.636 . . . . 0.0 112.636 -174.802 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 14.2 t-20 69.14 71.0 0.26 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 124.053 1.882 . . . . 0.0 111.74 -177.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.12 156.13 35.6 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 130.868 3.667 . . . . 0.0 103.614 168.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 m -94.9 87.72 5.06 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 125.331 1.452 . . . . 0.0 112.458 -163.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.29 -34.55 70.66 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 121.026 1.739 . . . . 0.0 110.706 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -20.52 62.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.72 2.408 . . . . 0.0 113.969 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -125.16 18.35 8.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.338 1.455 . . . . 0.0 112.145 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.7 ttm -60.62 119.67 8.55 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 169.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.68 154.8 36.29 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.069 -1.02 . . . . 0.0 109.458 -178.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.4 -34.62 75.66 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.466 -1.396 . . . . 0.0 112.951 -173.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -63.06 -34.62 77.98 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 172.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -76.14 -37.84 57.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.225 1.41 . . . . 0.0 111.253 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -62.14 -48.69 78.98 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.207 -0.933 . . . . 0.0 112.343 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.0 pt -70.35 -2.22 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 C-N-CA 123.671 0.788 . . . . 0.0 112.672 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -107.62 -15.33 14.61 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.86 1.664 . . . . 0.0 113.684 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.24 159.13 24.42 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.02 -1.05 . . . . 0.0 110.261 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.606 HD21 ' HD3' ' A' ' 19' ' ' LYS . 47.9 t-20 -67.01 128.09 93.75 Favored Pre-proline 0 N--CA 1.478 0.961 0 O-C-N 121.269 -0.894 . . . . 0.0 109.346 177.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -65.68 -20.72 59.47 Favored 'Trans proline' 0 N--CA 1.444 -1.397 0 C-N-CA 122.48 2.12 . . . . 0.0 111.636 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.8 mptt -48.79 -52.44 23.93 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 120.273 1.397 . . . . 0.0 108.697 169.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.66 0.04 40.45 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 31.6 mtt -65.89 -49.71 67.09 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 120.121 1.328 . . . . 0.0 112.199 173.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.25 -54.69 11.22 Favored Pre-proline 0 N--CA 1.49 1.564 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -176.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -60.05 -42.38 44.46 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.324 2.016 . . . . 0.0 113.725 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.402 HG22 ' HG2' ' B' ' 102' ' ' PRO . 12.0 t -63.2 -45.82 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.336 0.971 . . . . 0.0 111.023 177.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.61 91.13 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.71 1.204 . . . . 0.0 111.109 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 73.8 t90 -68.87 -52.99 23.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 117.794 -1.098 . . . . 0.0 112.651 170.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.425 ' CH2' ' HB3' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -51.57 -41.73 61.37 Favored 'General case' 0 C--N 1.347 0.486 0 CA-C-O 122.428 1.109 . . . . 0.0 111.491 -174.976 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -66.18 -44.29 84.42 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.488 1.515 . . . . 0.0 112.143 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -25.28 67.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.469 ' CD2' HD21 ' A' ' 75' ' ' ASN . 74.9 m-70 -107.7 -14.12 14.88 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 64.83 156.64 0.08 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.657 1.983 . . . . 0.0 112.386 -167.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -68.36 11.82 0.15 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 120.012 -1.68 . . . . 0.0 114.823 178.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 t -71.0 158.21 36.91 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.109 1.763 . . . . 0.0 113.452 -173.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.1 t -79.39 135.95 24.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 125.033 1.333 . . . . 0.0 109.643 174.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.46 168.84 18.91 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.82 -151.14 0.41 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.908 1.683 . . . . 0.0 111.332 -169.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.59 -21.32 72.65 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 124.114 0.864 . . . . 0.0 115.152 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -88.6 170.41 38.49 Favored Glycine 0 CA--C 1.537 1.447 0 CA-C-N 118.582 1.191 . . . . 0.0 113.629 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -107.4 12.24 28.17 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.124 1.37 . . . . 0.0 112.793 174.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.4 p -71.16 23.07 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.724 2.12 . . . . 0.0 116.724 -168.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.7 m -59.4 -22.85 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.655 0.782 . . . . 0.0 111.192 166.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -49.32 141.41 8.77 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 126.036 1.734 . . . . 0.0 112.569 169.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 54.2 mt -57.27 135.47 56.47 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 167.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.82 160.67 39.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.359 2.263 . . . . 0.0 109.854 -169.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.16 -18.57 64.58 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 119.547 -1.97 . . . . 0.0 114.497 -168.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 37.5 m -70.77 -58.54 3.52 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.901 -0.499 . . . . 0.0 110.719 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -65.89 -30.73 71.38 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.811 1.187 . . . . 0.0 113.198 -179.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.97 -27.69 68.34 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.773 1.169 . . . . 0.0 111.963 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.0 m -74.55 -36.99 63.12 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.701 0.4 . . . . 0.0 110.33 169.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -84.09 -27.24 28.38 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -174.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.94 -41.02 77.1 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 121.212 1.824 . . . . 0.0 112.489 176.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.48 -38.0 2.82 Favored 'Trans proline' 0 C--N 1.353 0.777 0 CA-C-N 122.301 1.858 . . . . 0.0 113.432 168.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -66.95 -30.68 70.88 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.509 -1.37 . . . . 0.0 113.802 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.9 m -70.47 -20.98 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.097 0.862 . . . . 0.0 112.556 173.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 mt -81.78 -50.73 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 O-C-N 121.48 -0.763 . . . . 0.0 110.242 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.38 -41.81 85.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.835 0.854 . . . . 0.0 111.747 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -70.89 -22.75 62.24 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.994 -1.066 . . . . 0.0 111.725 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.5 m -79.44 -45.25 19.8 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.498 172.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -27.49 68.89 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.825 1.648 . . . . 0.0 113.761 173.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -69.15 -38.15 78.63 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 168.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -128.74 68.44 78.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.791 1.236 . . . . 0.0 112.143 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -55.59 -15.8 13.09 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.471 2.781 . . . . 0.0 115.883 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -80.14 -25.05 40.03 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.918 1.687 . . . . 0.0 113.268 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -75.55 162.89 27.9 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.07 1.348 . . . . 0.0 112.186 -170.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -77.34 150.6 35.17 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.584 -0.697 . . . . 0.0 109.175 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.7 tp -67.28 -33.85 76.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -88.78 -22.59 23.2 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -169.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.7 t -59.74 -21.09 60.23 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.508 -0.745 . . . . 0.0 111.842 169.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -58.57 -14.62 8.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 119.529 -1.982 . . . . 0.0 113.747 171.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -34.33 72.7 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.101 1.319 . . . . 0.0 111.845 166.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -25.51 66.57 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.663 0.744 . . . . 0.0 112.447 -170.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -66.65 -33.85 76.57 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.602 1.961 . . . . 0.0 113.938 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.97 134.29 43.11 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -165.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.9 p -76.43 -50.75 13.3 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.177 0.991 . . . . 0.0 112.148 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.469 HD21 ' CD2' ' A' ' 30' ' ' HIS . 15.4 t-20 61.53 164.9 0.09 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 127.778 2.431 . . . . 0.0 114.188 -177.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -85.05 17.31 2.98 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 116.348 1.981 . . . . 0.0 116.348 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.55 158.11 88.54 Favored Pre-proline 0 CA--C 1.553 1.09 0 O-C-N 120.906 -1.121 . . . . 0.0 112.598 171.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.7 151.97 59.69 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.177 2.584 . . . . 0.0 114.185 176.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.036 1.334 . . . . 0.0 112.596 178.817 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 121.644 0.735 . . . . 0.0 111.874 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -132.41 55.78 1.87 Allowed 'General case' 0 C--O 1.211 -0.94 1 N-CA-C 99.345 -4.317 . . . . 0.0 99.345 166.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.272 9.6 mt-10 62.86 -175.26 0.15 Allowed 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.962 -1.086 . . . . 0.0 109.041 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' SER . . . . . 0.58 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 37.1 t -129.33 113.18 14.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.982 1.713 . . . . 0.0 113.804 -169.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 84' ' ' ALA . . . . . 0.444 ' HB2' ' O ' ' A' ' 19' ' ' LYS . . . -61.34 -32.59 72.48 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 119.702 -1.874 . . . . 0.0 111.354 169.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -62.18 -24.16 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.814 2.045 . . . . 0.0 114.048 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -115.64 11.43 15.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.368 1.467 . . . . 0.0 113.369 176.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 51.3 ttm -62.88 125.44 23.97 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.644 -1.285 . . . . 0.0 109.939 171.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 155.66 31.14 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.04 -1.038 . . . . 0.0 110.487 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.8 -32.01 73.5 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.163 -1.585 . . . . 0.0 113.186 -172.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.44 -30.94 71.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.804 0.729 . . . . 0.0 112.663 171.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -81.53 -33.88 31.52 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.859 1.664 . . . . 0.0 111.32 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -64.12 -48.51 75.8 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.854 0.861 . . . . 0.0 112.987 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.1 pt -68.9 -4.12 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 176.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.98 -11.48 16.64 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.222 1.809 . . . . 0.0 114.081 172.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 158.41 36.2 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.928 1.24 . . . . 0.0 110.856 175.225 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 44.1 t-20 -64.45 132.88 95.5 Favored Pre-proline 0 CA--C 1.551 1.003 0 O-C-N 121.246 -0.909 . . . . 0.0 111.871 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 25.4 Cg_exo -63.81 -15.03 46.58 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.921 2.414 . . . . 0.0 114.5 -178.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -55.51 -67.22 0.3 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.325 1.45 . . . . 0.0 108.868 167.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' ALA . . . . . 0.434 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -74.91 -14.35 60.64 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 33.3 ttm -56.48 -34.56 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.882 -1.136 . . . . 0.0 113.081 175.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 41.5 m -63.16 -58.15 17.45 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 102' ' ' PRO . . . . . 0.402 ' HG2' HG22 ' A' ' 24' ' ' VAL . 18.5 Cg_endo -55.42 -39.11 92.83 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 123.486 2.791 . . . . 0.0 112.469 169.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.434 HG23 ' O ' ' B' ' 99' ' ' ALA . 68.9 t -60.74 -43.69 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 120.059 -1.651 . . . . 0.0 111.478 176.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.18 -40.01 86.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.461 -0.78 . . . . 0.0 111.554 -175.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.425 ' HB3' ' CH2' ' A' ' 27' ' ' TRP 0.276 0.0 OUTLIER -74.61 -42.52 58.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 116.674 -1.631 . . . . 0.0 111.021 175.042 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.497 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -65.84 -22.5 66.55 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 122.353 2.342 . . . . 0.0 114.15 176.907 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 3.9 ttp -76.3 -49.45 16.93 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.387 1.075 . . . . 0.0 111.263 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.38 -32.92 73.34 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.649 0.779 . . . . 0.0 112.293 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -96.78 2.39 51.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.887 1.675 . . . . 0.0 113.82 170.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 38.0 58.1 1.5 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 126.47 1.908 . . . . 0.0 114.596 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 55.24 12.63 0.71 Allowed 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.9 t -64.7 157.25 27.86 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -169.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.4 p -86.42 157.22 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.675 1.19 . . . . 0.0 108.209 168.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . 0.297 0.5 OUTLIER -101.59 10.27 40.39 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -168.282 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 37.72 54.03 1.5 Allowed 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 126.99 2.116 . . . . 0.0 115.469 168.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.25 -4.96 82.29 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.884 1.706 . . . . 0.0 116.02 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.62 170.0 54.57 Favored Glycine 0 CA--C 1.536 1.39 0 CA-C-N 119.248 1.524 . . . . 0.0 114.155 174.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.79 -12.57 8.81 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.062 1.345 . . . . 0.0 114.12 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 2.7 p -77.16 32.44 0.15 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.964 1.706 . . . . 0.0 115.138 -172.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.03 -16.22 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.045 1.338 . . . . 0.0 112.407 168.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.27 152.86 4.19 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.248 1.419 . . . . 0.0 110.606 167.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.61 83.57 0.61 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 122.593 1.187 . . . . 0.0 110.499 170.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -62.58 162.53 10.33 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.658 2.383 . . . . 0.0 111.121 169.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.33 -26.01 66.28 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.035 -1.041 . . . . 0.0 113.606 -170.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 96.7 m -63.61 -49.24 74.08 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.682 0.674 . . . . 0.0 110.571 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -66.56 -41.47 88.56 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.381 -0.824 . . . . 0.0 112.072 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 97.6 mt -57.17 -30.58 64.61 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.272 0.942 . . . . 0.0 112.584 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 43.7 m -79.21 -36.73 39.67 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.695 0.798 . . . . 0.0 111.77 173.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -83.46 -29.74 27.78 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.67 -44.79 91.06 Favored Pre-proline 0 CA--C 1.553 1.069 0 CA-C-N 120.53 1.514 . . . . 0.0 112.526 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.95 -34.79 10.12 Favored 'Trans proline' 0 C--N 1.352 0.755 0 CA-C-N 122.363 1.88 . . . . 0.0 113.561 171.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -65.6 -33.6 76.27 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.392 -1.442 . . . . 0.0 113.562 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.03 -28.59 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.562 0.619 . . . . 0.0 111.792 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.7 mt -71.31 -48.22 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.5 171.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -54.92 -44.89 74.63 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.15 0.98 . . . . 0.0 111.66 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.57 -32.58 74.25 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.436 -0.79 . . . . 0.0 112.383 -178.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.77 -47.1 61.35 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.443 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.79 -29.98 67.42 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.568 1.531 . . . . 0.0 114.512 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 24.6 pttt -78.69 -23.59 45.51 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -134.64 73.22 68.05 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 125.017 1.327 . . . . 0.0 111.91 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -61.04 -12.71 23.93 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.705 2.937 . . . . 0.0 117.208 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -80.3 -21.52 42.52 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.587 1.155 . . . . 0.0 113.22 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -63.56 152.73 37.87 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.766 0.827 . . . . 0.0 111.795 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -85.97 132.17 34.13 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 66.8 tp -49.8 -43.51 48.58 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -168.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -75.93 -7.9 55.67 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.852 -1.155 . . . . 0.0 113.982 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 58.8 p -57.54 -25.98 60.72 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.343 -1.473 . . . . 0.0 111.38 168.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -70.76 -1.99 13.27 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.794 1.237 . . . . 0.0 113.914 177.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -32.44 50.87 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.65 1.18 . . . . 0.0 111.611 166.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -66.31 -28.5 68.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.506 1.122 . . . . 0.0 112.887 -168.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -73.56 -30.07 62.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.693 1.997 . . . . 0.0 115.757 169.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -94.73 123.56 38.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.491 1.116 . . . . 0.0 113.856 -167.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 27.6 m -103.69 -2.62 26.24 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -87.48 8.63 23.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -81.99 41.28 0.66 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.663 1.985 . . . . 0.0 114.413 -173.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.71 158.48 29.34 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 127.28 2.232 . . . . 0.0 111.918 -178.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -65.77 154.77 72.46 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.64 2.227 . . . . 0.0 112.401 169.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 . . . . . 0 C--O 1.253 1.287 0 C-N-CA 125.769 1.628 . . . . 0.0 112.31 179.538 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.294 0.2 OUTLIER 69.51 35.63 2.45 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.744 1.617 . . . . 0.0 114.511 172.683 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -76.5 164.19 26.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.181 2.592 . . . . 0.0 106.08 164.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.1 t -105.06 108.89 20.65 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 120.765 -1.209 . . . . 0.0 112.66 -166.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' B' ' 98' ' ' LYS . . . -63.27 -29.8 71.06 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.796 -1.19 . . . . 0.0 111.209 170.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 14.5 mtmt -60.25 -44.62 95.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.527 1.131 . . . . 0.0 112.281 175.094 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -99.33 15.02 27.59 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.807 1.243 . . . . 0.0 113.982 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 57.2 ttm -60.78 126.14 26.3 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -78.57 154.75 30.1 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.288 -1.508 . . . . 0.0 110.491 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.51 -34.0 74.76 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.314 -1.491 . . . . 0.0 112.968 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -62.1 -31.61 72.09 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.791 0.836 . . . . 0.0 113.251 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -80.49 -36.03 33.93 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.402 1.481 . . . . 0.0 111.348 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -59.86 -48.85 80.01 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.354 -0.841 . . . . 0.0 111.981 175.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.0 pt -71.51 -2.11 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 125.056 1.342 . . . . 0.0 113.246 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.64 -13.02 16.11 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.343 1.457 . . . . 0.0 113.155 170.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.82 158.6 35.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.313 1.045 . . . . 0.0 111.31 175.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 7.1 t-20 -64.65 139.7 97.83 Favored Pre-proline 0 N--CA 1.48 1.026 0 C-N-CA 123.719 0.808 . . . . 0.0 112.443 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' ASN 0.284 12.1 Cg_exo -78.39 -9.7 16.21 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 CA-C-N 120.809 1.325 . . . . 0.0 114.31 -174.539 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.602 ' HB2' ' HE2' ' B' ' 87' ' ' MET . 28.6 mttp -66.54 -54.22 26.11 Favored 'General case' 0 C--N 1.356 0.867 0 CA-C-N 120.338 1.426 . . . . 0.0 107.521 166.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.505 ' HB1' HG21 ' B' ' 103' ' ' VAL . . . -79.16 -5.92 55.32 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.5 mtt -58.64 -51.84 68.23 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.351 0.978 . . . . 0.0 111.821 170.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.3 m -54.53 -49.82 88.85 Favored Pre-proline 0 N--CA 1.482 1.159 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -173.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.501 ' HG2' HG22 ' B' ' 103' ' ' VAL . 9.8 Cg_endo -53.5 -45.95 37.29 Favored 'Trans proline' 0 N--CA 1.476 0.489 0 C-N-CA 123.227 2.618 . . . . 0.0 116.47 170.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.31 -41.28 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 120.841 -1.162 . . . . 0.0 112.469 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.26 -27.96 67.68 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.371 1.068 . . . . 0.0 111.125 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 57.6 t90 -82.0 -51.13 8.35 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-O 117.189 -1.386 . . . . 0.0 113.103 170.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.9 t90 -62.96 -31.43 72.53 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 120.652 1.569 . . . . 0.0 110.797 -168.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 62.4 ttp -57.68 -51.88 67.73 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.041 1.336 . . . . 0.0 112.12 167.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.49 -28.84 68.88 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.374 1.47 . . . . 0.0 113.887 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -114.07 -26.86 7.9 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -173.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 67.28 142.28 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 128.826 2.851 . . . . 0.0 117.373 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -72.73 -16.66 61.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.312 1.445 . . . . 0.0 113.504 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 66.2 p -71.62 29.25 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 128.556 2.742 . . . . 0.0 116.524 -168.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.0 t 67.96 138.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 128.629 2.772 . . . . 0.0 114.194 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -90.11 17.98 6.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.531 1.532 . . . . 0.0 114.509 -169.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.323 0.2 OUTLIER 39.29 45.92 1.23 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 128.306 2.642 . . . . 0.0 114.793 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.37 5.0 89.96 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.726 1.631 . . . . 0.0 115.611 174.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.01 166.44 54.72 Favored Glycine 0 CA--C 1.535 1.303 0 CA-C-N 118.661 1.23 . . . . 0.0 114.263 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -115.99 -177.39 3.15 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.502 1.521 . . . . 0.0 112.271 172.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.3 m 58.22 41.11 24.06 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 122.765 1.269 . . . . 0.0 111.4 -169.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.2 m -66.27 -7.61 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.14 0.976 . . . . 0.0 112.364 168.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.39 147.8 5.59 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.92 2.088 . . . . 0.0 111.956 170.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -62.19 115.66 4.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 167.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -120.9 177.08 5.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.451 1.1 . . . . 0.0 113.245 -168.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -67.72 -21.38 65.3 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.762 -1.211 . . . . 0.0 114.089 -171.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -67.45 -42.86 82.38 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.2 0.909 . . . . 0.0 110.279 169.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -62.53 -47.84 82.13 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.641 -0.662 . . . . 0.0 110.697 173.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 81.6 mt -63.56 -26.05 68.52 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.058 -1.026 . . . . 0.0 112.501 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.3 m -75.27 -38.75 60.32 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.015 0.526 . . . . 0.0 110.958 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -86.91 -27.91 23.09 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.041 -0.981 . . . . 0.0 113.628 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.6 mp -51.78 -43.63 88.83 Favored Pre-proline 0 CA--C 1.551 0.998 0 CA-C-N 120.641 1.564 . . . . 0.0 113.005 175.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.21 -39.56 7.4 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 122.054 1.769 . . . . 0.0 113.555 169.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.64 -37.52 87.65 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.431 1.014 . . . . 0.0 112.909 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.49 -26.23 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 177.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.6 mt -73.74 -52.47 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 121.776 -0.578 . . . . 0.0 110.195 173.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -55.45 -49.27 72.89 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.611 0.765 . . . . 0.0 110.502 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -65.45 -25.51 67.55 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.514 -0.741 . . . . 0.0 112.019 -176.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.67 -47.98 15.91 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.125 0.875 . . . . 0.0 112.295 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -26.68 68.4 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.662 1.574 . . . . 0.0 113.748 174.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 mtpp -72.75 -29.03 62.99 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.778 1.631 . . . . 0.0 114.492 169.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -135.04 66.79 68.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.138 1.375 . . . . 0.0 112.397 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -57.65 -13.55 14.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 123.514 2.809 . . . . 0.0 116.914 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -83.97 -21.06 31.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.226 1.41 . . . . 0.0 113.762 -178.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -69.06 156.0 39.39 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.928 0.891 . . . . 0.0 111.775 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -92.84 122.75 35.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.7 tp -42.69 -52.9 4.74 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -165.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.411 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.4 m-85 -68.32 -8.11 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -173.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -55.69 -28.16 54.12 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 121.021 -1.049 . . . . 0.0 111.294 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -71.99 -1.22 13.77 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.642 1.577 . . . . 0.0 114.336 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -31.61 25.89 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.183 1.356 . . . . 0.0 110.936 166.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.53 -26.65 64.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.937 0.895 . . . . 0.0 111.909 -170.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -72.97 -28.99 62.73 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.553 1.541 . . . . 0.0 114.937 171.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.32 103.82 14.8 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.165 1.386 . . . . 0.0 113.78 -167.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 51.0 m -78.84 79.94 5.22 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.477 1.111 . . . . 0.0 110.685 171.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -70.67 172.28 8.94 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.68 1.192 . . . . 0.0 112.314 -176.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -74.5 29.12 0.08 Allowed 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.75 2.13 . . . . 0.0 116.75 -168.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.07 152.9 79.81 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 125.13 1.372 . . . . 0.0 112.395 173.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.56 162.57 42.01 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.995 2.463 . . . . 0.0 112.139 170.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.343 0 C-N-CA 125.786 1.634 . . . . 0.0 112.175 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.332 10.4 t-20 72.59 26.21 2.52 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.735 1.614 . . . . 0.0 114.753 176.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.501 ' HB3' ' HG2' ' A' ' 19' ' ' LYS . 3.2 mm-40 -74.25 159.18 32.82 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.779 2.431 . . . . 0.0 105.376 163.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.1 t -105.38 103.51 13.05 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 120.264 -1.523 . . . . 0.0 113.746 -164.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.21 -35.68 67.59 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.758 -1.214 . . . . 0.0 110.275 170.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -66.53 -20.61 66.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.398 2.279 . . . . 0.0 115.512 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -123.65 9.4 8.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.628 1.171 . . . . 0.0 113.213 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' MET . . . . . 0.602 ' HE2' ' HB2' ' A' ' 19' ' ' LYS . 27.9 ttm -61.4 134.04 56.47 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 120.552 -1.342 . . . . 0.0 109.858 169.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 9.3 p -71.81 169.85 14.88 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 121.948 0.88 . . . . 0.0 112.381 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.2 m -70.37 -38.68 74.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.933 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -63.78 -37.73 88.45 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.416 1.007 . . . . 0.0 112.37 173.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -73.12 -39.03 66.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.483 1.113 . . . . 0.0 111.598 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -61.5 -49.46 76.66 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.431 -0.793 . . . . 0.0 113.105 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.3 pt -68.41 -4.72 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 176.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -105.9 -10.75 16.48 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.282 1.833 . . . . 0.0 114.058 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 158.84 34.72 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.767 1.167 . . . . 0.0 110.887 176.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -58.11 134.21 84.18 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.186 0.995 . . . . 0.0 113.164 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.95 -16.86 32.49 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 122.693 2.262 . . . . 0.0 115.686 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 5' ' ' ALA . 9.0 mptt -63.7 -49.23 73.93 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 121.003 1.729 . . . . 0.0 109.716 170.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 99' ' ' ALA . . . . . 0.487 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -86.38 -16.03 38.58 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.4 ttm -54.6 -34.86 62.68 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.462 -1.399 . . . . 0.0 113.236 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 56.3 m -65.58 -57.38 14.61 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-O 117.535 -1.222 . . . . 0.0 112.911 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -52.79 -38.72 78.25 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.881 3.054 . . . . 0.0 114.444 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.505 HG21 ' HB1' ' A' ' 20' ' ' ALA . 58.4 t -62.83 -52.61 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 121.9 -0.5 . . . . 0.0 111.286 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.94 -40.99 95.37 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.291 1.037 . . . . 0.0 110.842 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 82.5 t90 -68.19 -50.04 56.89 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.577 -1.201 . . . . 0.0 112.626 175.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.414 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.2 t90 -67.77 -29.91 69.23 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 120.746 1.612 . . . . 0.0 111.56 -168.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.8 tmm? -60.41 -48.5 81.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.578 1.151 . . . . 0.0 111.577 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.9 -24.84 60.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.89 1.276 . . . . 0.0 113.18 -178.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -136.8 85.6 2.15 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.949 1.699 . . . . 0.0 109.652 -177.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -48.67 154.69 0.65 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.282 2.233 . . . . 0.0 117.008 -169.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -71.27 1.25 6.35 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.335 2.254 . . . . 0.0 115.519 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 t -71.23 171.54 10.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.417 1.487 . . . . 0.0 112.607 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.18 141.34 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.413 1.085 . . . . 0.0 111.758 -178.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -81.35 172.86 13.06 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.967 0.907 . . . . 0.0 113.022 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.72 138.19 50.99 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.749 1.62 . . . . 0.0 109.976 169.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.66 -3.22 44.05 Favored Glycine 0 CA--C 1.542 1.774 0 N-CA-C 117.106 1.602 . . . . 0.0 117.106 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -171.72 -169.3 34.4 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-N 119.936 1.868 . . . . 0.0 115.318 178.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -133.68 32.84 3.54 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 126.766 2.026 . . . . 0.0 113.406 -169.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 22.4 p -74.32 60.37 0.83 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 127.068 2.147 . . . . 0.0 115.32 -168.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 35.7 m -69.26 -8.9 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.434 1.094 . . . . 0.0 112.171 167.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.9 153.68 8.27 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 129.569 3.148 . . . . 0.0 114.024 171.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -74.13 127.18 32.27 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.621 0.768 . . . . 0.0 109.968 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -91.22 161.12 15.19 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.568 1.147 . . . . 0.0 109.974 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.99 -26.93 68.79 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.419 -1.425 . . . . 0.0 112.001 174.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 32.9 m -60.83 -42.21 97.29 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.222 1.009 . . . . 0.0 111.107 168.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -66.31 -50.02 65.06 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.196 0.907 . . . . 0.0 110.732 174.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -56.01 -32.61 64.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.748 0.819 . . . . 0.0 112.265 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 26.1 m -80.86 -38.53 27.98 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.648 0.779 . . . . 0.0 112.287 173.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -78.0 -31.83 50.84 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 117.321 -1.324 . . . . 0.0 114.452 -175.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.51 -46.37 90.55 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 121.2 1.818 . . . . 0.0 112.998 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.25 -38.54 8.77 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 121.941 1.729 . . . . 0.0 113.428 172.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -67.54 -31.73 72.02 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.746 -1.221 . . . . 0.0 113.773 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.3 -26.86 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 118.384 0.538 . . . . 0.0 111.994 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 39.7 mt -71.0 -50.18 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.701 0.8 . . . . 0.0 109.715 171.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.93 -45.48 82.7 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.759 0.824 . . . . 0.0 111.813 175.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.88 -24.87 65.28 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.653 -1.279 . . . . 0.0 112.299 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.9 -46.94 19.89 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.916 0.78 . . . . 0.0 112.207 176.323 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -26.19 68.04 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 120.363 1.438 . . . . 0.0 113.981 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -68.92 -31.1 69.77 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 168.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -133.05 63.83 68.27 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 124.872 1.269 . . . . 0.0 112.322 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -56.9 -20.03 34.43 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.166 2.578 . . . . 0.0 116.435 -171.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -80.2 -16.77 54.07 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.605 1.162 . . . . 0.0 113.283 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -74.25 165.89 24.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.612 1.165 . . . . 0.0 112.219 -172.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -80.46 151.57 29.21 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 49.2 tp -68.56 -38.97 81.21 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.2 -20.16 30.59 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -169.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.8 t -62.06 -16.47 52.23 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.048 -1.033 . . . . 0.0 112.127 171.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.5 -4.04 5.31 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 119.512 -1.992 . . . . 0.0 114.336 168.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.13 -28.35 35.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.293 1.437 . . . . 0.0 111.988 166.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -65.17 -35.47 81.19 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.175 1.39 . . . . 0.0 112.075 -174.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -70.78 -28.22 64.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.348 1.859 . . . . 0.0 114.948 173.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.95 102.66 12.74 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -167.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.1 m -79.03 70.43 5.37 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.574 1.15 . . . . 0.0 110.542 169.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.91 165.12 16.07 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.056 1.343 . . . . 0.0 112.422 -177.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -70.29 138.72 51.79 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -171.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.8 mp -133.03 150.53 75.83 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.876 1.67 . . . . 0.0 109.219 168.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -65.87 165.38 23.76 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.596 2.197 . . . . 0.0 114.659 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 127.012 2.125 . . . . 0.0 113.951 178.483 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.975 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.257 8.4 t-20 60.0 40.43 18.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.902 1.681 . . . . 0.0 115.096 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -62.18 -24.53 67.25 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.243 1.017 . . . . 0.0 112.681 168.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 93.75 104.4 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.982 2.913 . . . . 0.0 117.45 167.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.49 -29.06 68.83 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 119.855 -1.778 . . . . 0.0 112.306 169.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 7.7 mtmt -65.28 -30.85 71.75 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.145 1.378 . . . . 0.0 114.118 174.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -100.8 4.95 43.32 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.479 1.111 . . . . 0.0 113.077 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.9 ttm -63.89 139.83 58.81 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 119.604 1.093 . . . . 0.0 110.487 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.3 p -78.44 175.88 9.89 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.038 -1.038 . . . . 0.0 112.247 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.31 -39.72 53.36 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.702 171.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.78 -35.96 79.69 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.11 0.868 . . . . 0.0 112.23 171.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -75.72 -38.55 58.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.66 1.184 . . . . 0.0 111.948 176.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -57.5 -50.58 72.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 121.478 -0.764 . . . . 0.0 112.792 176.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.9 pt -68.26 -4.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 C-N-CA 124.094 0.958 . . . . 0.0 112.519 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -106.98 -13.61 15.16 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.337 1.455 . . . . 0.0 114.291 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.73 163.77 27.18 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 120.892 -1.13 . . . . 0.0 111.048 173.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.49 HD21 ' HD3' ' A' ' 19' ' ' LYS . 44.0 t-20 -65.07 131.52 95.19 Favored Pre-proline 0 N--CA 1.484 1.23 0 O-C-N 120.683 -1.261 . . . . 0.0 112.531 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.94 -16.16 37.08 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.82 3.014 . . . . 0.0 115.669 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.49 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.9 mptt -58.17 -65.49 0.64 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 125.776 1.631 . . . . 0.0 108.899 167.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.456 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -78.02 -9.61 59.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -177.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 83.7 mtp -58.1 -35.97 72.2 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.797 1.181 . . . . 0.0 112.749 171.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.5 m -64.19 -55.95 27.56 Favored Pre-proline 0 N--CA 1.484 1.236 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.23 -35.31 95.39 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.325 2.683 . . . . 0.0 114.224 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 20' ' ' ALA . 95.1 t -63.1 -52.36 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.392 0.677 . . . . 0.0 111.617 173.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.97 -39.32 91.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.045 1.338 . . . . 0.0 110.708 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 72.4 t90 -67.74 -51.86 44.3 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-O 116.944 -1.503 . . . . 0.0 112.644 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.455 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.4 t90 -67.28 -25.05 65.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.973 1.715 . . . . 0.0 111.7 -169.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -67.66 -46.19 73.1 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.448 1.099 . . . . 0.0 111.702 169.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -41.21 98.39 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -110.84 90.6 3.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.712 1.205 . . . . 0.0 112.161 172.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -65.19 144.93 56.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.501 1.92 . . . . 0.0 113.862 -169.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.67 3.76 2.3 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.7 t -75.24 30.47 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.897 2.079 . . . . 0.0 114.861 -170.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.8 t 62.78 128.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 128.933 2.893 . . . . 0.0 113.788 -171.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 170.11 17.09 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.927 1.291 . . . . 0.0 112.19 -178.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 138.03 49.65 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.942 1.297 . . . . 0.0 110.137 173.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.03 -43.65 0.52 Allowed Glycine 0 CA--C 1.542 1.72 0 C-N-CA 125.606 1.575 . . . . 0.0 114.653 -171.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 92.5 -171.11 33.16 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.525 1.536 . . . . 0.0 113.848 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.1 t70 62.11 -44.69 0.17 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 128.502 2.721 . . . . 0.0 117.315 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 m -71.28 6.14 1.87 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.394 1.478 . . . . 0.0 114.744 -171.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.4 m -58.89 -10.77 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.26 1.824 . . . . 0.0 112.954 168.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 p -50.15 161.12 0.3 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.859 2.063 . . . . 0.0 113.48 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.7 mt -78.71 92.69 4.81 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.303 -0.873 . . . . 0.0 108.724 167.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -71.75 164.92 25.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.33 1.052 . . . . 0.0 109.717 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.19 -28.08 69.14 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.033 -1.667 . . . . 0.0 112.685 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 m -63.48 -42.31 98.57 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.384 -0.823 . . . . 0.0 110.84 168.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -67.28 -42.45 83.76 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.963 -1.086 . . . . 0.0 110.584 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.57 -26.89 68.82 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.316 -0.865 . . . . 0.0 111.794 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.4 m -77.91 -36.21 49.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.221 1.008 . . . . 0.0 111.502 171.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.99 -28.97 29.33 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.31 -39.69 73.61 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-O 117.176 -1.392 . . . . 0.0 112.78 177.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.597 ' HA ' HD12 ' A' ' 55' ' ' ILE . 44.8 Cg_endo -73.98 -37.94 2.51 Favored 'Trans proline' 0 C--N 1.354 0.825 0 CA-C-N 122.307 1.859 . . . . 0.0 113.317 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -66.46 -32.41 73.75 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.486 -1.383 . . . . 0.0 113.683 -176.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.62 -17.31 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.597 HD12 ' HA ' ' A' ' 52' ' ' PRO . 11.3 mt -83.45 -52.82 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.416 1.087 . . . . 0.0 109.633 172.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -56.41 -49.9 73.19 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.027 0.931 . . . . 0.0 110.735 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -62.34 -24.77 67.53 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.438 -0.789 . . . . 0.0 111.596 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.73 -47.39 14.03 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.397 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -27.87 69.58 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.848 1.658 . . . . 0.0 113.696 172.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -73.02 -30.52 63.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.787 1.635 . . . . 0.0 115.115 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -131.59 66.62 78.64 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.227 1.411 . . . . 0.0 110.479 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -60.57 -14.36 30.5 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.592 2.861 . . . . 0.0 114.646 -174.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -79.12 -26.29 42.88 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.158 1.783 . . . . 0.0 112.685 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -69.17 162.71 26.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.65 1.18 . . . . 0.0 112.624 -169.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -94.82 131.4 40.74 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.2 tp -52.29 -35.81 51.28 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -166.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.267 5.0 m-85 -82.55 -5.45 58.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.351 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 60.5 p -60.49 -27.81 67.87 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 120.168 -1.583 . . . . 0.0 111.357 168.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -70.6 -4.11 21.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.512 1.525 . . . . 0.0 114.114 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -32.2 40.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.994 1.717 . . . . 0.0 111.316 169.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -72.7 -25.45 61.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.089 1.356 . . . . 0.0 112.176 -171.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -76.19 -31.59 58.55 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.14 -49.9 5.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -167.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 45.3 m 46.2 32.97 1.61 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -85.92 2.42 46.13 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.134 1.374 . . . . 0.0 114.346 -173.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -94.06 53.32 1.74 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.404 1.882 . . . . 0.0 114.993 -166.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.31 160.02 28.5 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.433 1.893 . . . . 0.0 111.462 172.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -61.96 143.71 95.64 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.004 2.47 . . . . 0.0 112.081 168.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.927 1.291 . . . . 0.0 113.003 175.913 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.956 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.307 0.3 OUTLIER 69.03 34.99 2.92 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 171.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -76.01 157.39 33.08 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 163.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 21.0 t -94.26 99.51 11.74 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 120.672 -1.268 . . . . 0.0 113.689 -166.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.32 -33.6 63.45 Favored 'General case' 0 CA--C 1.554 1.123 0 O-C-N 120.827 -1.17 . . . . 0.0 110.911 169.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.43 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 13.5 mtmt -62.54 -37.77 87.41 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.679 1.992 . . . . 0.0 114.199 176.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -106.63 12.82 28.91 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.927 1.291 . . . . 0.0 112.672 -178.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 60.2 ttm -58.48 132.17 52.93 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 121.108 -0.995 . . . . 0.0 108.5 169.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 11.7 p -74.56 172.35 12.17 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.218 -0.926 . . . . 0.0 111.765 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.58 -36.22 73.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.94 170.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -63.67 -35.89 82.05 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.361 0.982 . . . . 0.0 112.462 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.01 -34.75 50.53 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.921 1.288 . . . . 0.0 111.885 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 92' ' ' PHE . . . . . 0.538 ' HA ' HD12 ' B' ' 95' ' ' LEU . 93.6 t80 -68.7 -37.13 79.29 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.964 -1.085 . . . . 0.0 113.52 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.4 pt -77.64 3.8 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 O-C-N 120.844 -1.16 . . . . 0.0 112.026 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -120.03 -32.24 4.24 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -177.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' B' ' 92' ' ' PHE . 0.0 OUTLIER -64.42 162.81 14.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.231 1.832 . . . . 0.0 111.906 172.862 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.491 HD21 ' HD3' ' B' ' 98' ' ' LYS . 48.5 t-20 -63.69 132.22 95.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.805 -168.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.0 -22.22 29.92 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.029 3.153 . . . . 0.0 115.378 176.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.491 ' HD3' HD21 ' B' ' 96' ' ' ASN . 14.6 mttt -56.64 -59.83 4.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.125 1.77 . . . . 0.0 109.365 167.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.75 -14.74 47.35 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 30.5 ttm -53.92 -36.18 62.48 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.947 0.899 . . . . 0.0 111.197 168.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 28.4 m -65.97 -57.65 13.01 Favored Pre-proline 0 N--CA 1.479 0.986 0 CA-C-O 117.862 -1.066 . . . . 0.0 112.818 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -51.23 -41.79 56.68 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.983 3.122 . . . . 0.0 115.188 170.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.92 -37.8 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.606 1.094 . . . . 0.0 113.289 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.16 -33.91 76.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.234 0.613 . . . . 0.0 111.047 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 84.6 t90 -75.91 -50.38 15.17 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-O 117.722 -1.132 . . . . 0.0 112.349 175.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.436 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 1.5 t90 -67.06 -25.51 66.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 117.924 -1.51 . . . . 0.0 111.16 -170.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 54.9 ttp -60.97 -53.36 58.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.638 1.175 . . . . 0.0 111.319 168.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.66 -31.64 66.5 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.775 1.23 . . . . 0.0 112.411 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -124.12 70.7 1.1 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.452 1.501 . . . . 0.0 112.295 175.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.36 -172.44 0.59 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -172.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 68.26 -2.25 1.6 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.826 2.05 . . . . 0.0 114.942 -178.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 9.4 p 58.18 13.06 2.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 126.228 1.811 . . . . 0.0 114.621 -170.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 49.1 t -124.53 141.68 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 126.378 1.871 . . . . 0.0 110.217 -169.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -126.36 117.88 23.89 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.725 1.21 . . . . 0.0 110.55 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -123.5 -7.57 8.06 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -169.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -82.72 -12.0 80.74 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 124.261 0.934 . . . . 0.0 114.225 174.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 171.05 -147.8 10.7 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.893 1.711 . . . . 0.0 111.758 -178.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 47.0 p-10 -132.86 22.88 4.22 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.32 1.448 . . . . 0.0 112.889 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 20.5 p -76.27 -62.77 1.5 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.561 1.145 . . . . 0.0 113.526 -171.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 24.3 m 41.13 39.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 125.835 1.654 . . . . 0.0 113.539 -172.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.51 -21.03 61.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 128.52 2.728 . . . . 0.0 116.264 -169.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 63.51 71.71 0.49 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.36 1.464 . . . . 0.0 108.762 -167.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 43.1 p30 -76.7 176.38 8.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.997 1.319 . . . . 0.0 113.12 -170.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.29 -25.07 66.68 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.794 -1.191 . . . . 0.0 112.96 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.9 m -66.87 -42.52 85.49 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.274 -0.892 . . . . 0.0 110.909 170.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -64.03 -46.34 84.85 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.973 1.26 . . . . 0.0 111.288 173.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.9 mt -57.17 -27.13 61.64 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.756 0.707 . . . . 0.0 112.624 174.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.4 m -81.08 -37.84 28.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.492 1.117 . . . . 0.0 111.783 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -84.47 -29.95 25.64 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.895 1.442 . . . . 0.0 114.895 -175.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.15 -44.51 98.6 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 120.489 1.495 . . . . 0.0 112.111 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.27 -35.64 18.34 Favored 'Trans proline' 0 C--N 1.353 0.781 0 CA-C-N 122.205 1.823 . . . . 0.0 113.718 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.76 -38.66 91.45 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.453 1.479 . . . . 0.0 112.869 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 m -69.09 -29.19 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.41 -52.15 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.08 0.952 . . . . 0.0 109.9 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -58.19 -42.83 86.97 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.814 0.846 . . . . 0.0 112.386 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -68.32 -27.64 66.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.809 0.844 . . . . 0.0 112.454 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.46 -48.92 15.93 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.364 -0.835 . . . . 0.0 112.906 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -24.93 66.06 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -75.42 -23.36 56.99 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 170.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -138.6 71.95 43.59 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.603 1.161 . . . . 0.0 111.997 172.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -59.14 -16.96 36.14 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.615 2.877 . . . . 0.0 116.772 -172.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -78.33 -16.98 57.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.596 1.158 . . . . 0.0 113.32 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -71.91 164.96 25.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.017 1.327 . . . . 0.0 111.717 -174.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -80.7 159.18 25.34 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 110.366 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.58 -64.82 0.91 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.775 -0.578 . . . . 0.0 112.395 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.43 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 2.7 m-85 -62.49 -21.3 65.38 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -167.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.8 t -55.87 -26.17 45.75 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.477 -0.764 . . . . 0.0 112.31 171.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -64.71 -2.29 2.39 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.823 -1.798 . . . . 0.0 113.748 173.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -72.28 -34.74 68.42 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.668 1.122 . . . . 0.0 111.839 165.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.52 -32.95 73.01 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -167.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 151' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' B' ' 151' ' ' GLN . 8.1 pt20 -73.55 -28.02 61.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.127 2.171 . . . . 0.0 115.706 175.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -111.48 100.37 8.95 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -165.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 44.2 p -96.32 45.39 1.07 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.06 1.744 . . . . 0.0 114.591 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -68.26 120.07 13.82 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.594 -1.316 . . . . 0.0 112.933 -176.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.7 t70 58.18 -64.41 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.161 2.984 . . . . 0.0 116.814 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.18 153.27 94.41 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.941 1.296 . . . . 0.0 112.277 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.99 142.76 57.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.449 2.099 . . . . 0.0 111.523 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 56.6 t30 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 126.306 1.842 . . . . 0.0 113.08 -173.535 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.924 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.382 13.5 t-20 75.91 51.8 0.06 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 127.345 2.258 . . . . 0.0 112.759 -174.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 pm0 -64.33 -161.35 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.828 1 C-N-CA 132.942 4.497 . . . . 0.0 112.037 166.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.502 ' H ' ' HG3' ' B' ' 98' ' ' LYS . 26.8 t -148.4 88.5 1.64 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 113.853 -1.522 . . . . 0.0 109.335 167.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' B' ' 98' ' ' LYS . . . -57.69 -31.74 66.67 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.653 -1.279 . . . . 0.0 110.74 171.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 8.9 mttt -50.12 -49.55 51.44 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.602 1.961 . . . . 0.0 111.728 170.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -100.71 16.43 24.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.287 1.435 . . . . 0.0 113.842 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -55.83 124.13 16.52 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 167.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.5 t -75.48 153.12 37.73 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 120.9 -1.125 . . . . 0.0 110.141 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.23 -32.7 73.41 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.063 -1.648 . . . . 0.0 112.935 -175.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -64.93 -31.0 72.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.91 0.884 . . . . 0.0 112.606 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -77.96 -37.7 46.88 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.193 1.397 . . . . 0.0 111.556 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.98 -49.41 77.77 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.455 -0.778 . . . . 0.0 112.885 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.3 pt -68.42 -5.79 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.669 1.188 . . . . 0.0 113.152 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -110.6 -8.45 14.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.811 1.644 . . . . 0.0 113.74 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.92 159.54 32.65 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 121.057 -1.027 . . . . 0.0 110.329 175.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -65.43 128.65 93.98 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 121.19 -0.944 . . . . 0.0 111.837 -173.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.62 -15.56 12.66 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.777 2.985 . . . . 0.0 115.567 178.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -62.5 -72.41 0.13 Allowed 'General case' 0 C--N 1.349 0.557 0 C-N-CA 126.423 1.889 . . . . 0.0 109.463 166.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.51 -4.11 43.95 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -177.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.9 ttt -58.18 -39.95 80.22 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 112.92 170.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.263 20.1 m -66.21 -51.39 44.85 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -50.16 -45.12 34.92 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.453 2.768 . . . . 0.0 115.841 169.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 p -73.69 -39.0 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.204 0.911 . . . . 0.0 113.358 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.72 -26.3 68.61 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.197 0.999 . . . . 0.0 111.676 172.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 65.5 t90 -83.61 -51.78 7.01 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.378 171.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.453 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.9 t90 -66.02 -34.85 79.03 Favored 'General case' 0 C--N 1.348 0.521 0 CA-C-N 120.329 1.422 . . . . 0.0 112.026 -167.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -55.85 -38.82 70.58 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.694 1.198 . . . . 0.0 112.168 171.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -36.95 68.1 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.257 1.423 . . . . 0.0 112.853 -169.007 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -91.47 -32.07 15.73 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.044 0.937 . . . . 0.0 113.038 169.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.8 tt0 73.1 153.97 0.14 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 129.013 2.925 . . . . 0.0 114.036 -169.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 11.48 0.22 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.2 t -64.09 -9.81 18.65 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.295 2.238 . . . . 0.0 114.151 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.446 ' O ' ' HE3' ' A' ' 36' ' ' LYS 0.278 0.4 OUTLIER 76.61 160.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 127.856 2.463 . . . . 0.0 115.191 -177.459 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -86.94 95.22 9.83 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.266 1.826 . . . . 0.0 109.739 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' A' ' 34' ' ' VAL . 14.7 mmtp -58.24 134.5 56.59 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.594 0.711 . . . . 0.0 112.785 -169.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.79 -6.36 3.74 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.828 1.68 . . . . 0.0 116.093 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.09 155.1 5.54 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.308 1.554 . . . . 0.0 113.424 -172.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -159.41 -176.04 5.56 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.839 1.656 . . . . 0.0 108.092 -175.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -62.64 -31.86 72.79 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.843 -1.161 . . . . 0.0 109.564 164.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t 60.62 70.33 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.467 1.907 . . . . 0.0 112.557 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.5 p -118.33 154.19 32.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.541 1.136 . . . . 0.0 113.103 -177.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -72.13 82.57 0.99 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.586 1.184 . . . . 0.0 110.157 169.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -65.26 164.06 14.13 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.835 2.054 . . . . 0.0 111.739 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.44 -24.35 65.62 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.931 -1.105 . . . . 0.0 113.646 -171.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 m -61.92 -48.77 78.96 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.317 0.962 . . . . 0.0 110.676 169.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -57.81 -49.5 76.43 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.253 0.933 . . . . 0.0 110.385 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.33 -29.29 68.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.591 0.756 . . . . 0.0 112.259 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.7 m -78.74 -34.05 46.1 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.871 1.268 . . . . 0.0 111.857 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -79.14 -26.56 42.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.466 -1.254 . . . . 0.0 113.139 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mm -53.74 -46.13 98.49 Favored Pre-proline 0 N--CA 1.479 0.976 0 CA-C-N 120.327 1.421 . . . . 0.0 112.76 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.22 -37.24 14.57 Favored 'Trans proline' 0 C--N 1.352 0.731 0 CA-C-N 121.701 1.643 . . . . 0.0 113.141 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.88 -37.3 85.76 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.829 -1.169 . . . . 0.0 113.364 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.72 -16.96 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.221 0.608 . . . . 0.0 112.582 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mt -85.12 -49.69 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 124.238 1.015 . . . . 0.0 110.232 171.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -57.47 -39.62 76.76 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.949 0.9 . . . . 0.0 111.758 176.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -71.38 -23.63 61.93 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.19 -0.943 . . . . 0.0 111.67 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -81.09 -44.2 18.34 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.051 -1.031 . . . . 0.0 112.151 175.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -27.4 69.28 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 120.549 1.522 . . . . 0.0 113.698 172.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -71.76 -35.79 70.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -126.98 62.2 50.77 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.876 1.27 . . . . 0.0 111.376 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.96 -17.15 10.28 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.707 3.605 . . . . 0.0 116.071 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -83.28 -22.9 32.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.589 1.555 . . . . 0.0 113.183 -176.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -68.53 159.24 32.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.077 0.951 . . . . 0.0 112.473 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -97.54 118.15 33.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 -175.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -43.24 -43.88 5.01 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -165.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.443 ' CG ' ' HA ' ' A' ' 6' ' ' LYS 0.251 4.3 m-30 -72.01 -8.23 53.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 120.445 1.475 . . . . 0.0 114.06 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.2 p -58.74 -27.48 64.98 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 120.255 -1.528 . . . . 0.0 111.838 167.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -70.54 -11.67 61.08 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.581 -1.324 . . . . 0.0 112.664 177.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -68.8 -30.68 69.3 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.516 1.127 . . . . 0.0 112.057 169.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -69.41 -16.67 63.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 112.003 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -79.79 -26.37 40.62 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.266 2.226 . . . . 0.0 114.396 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -104.03 -98.16 0.31 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -163.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.1 m 53.2 59.37 4.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 125.48 1.512 . . . . 0.0 111.974 -168.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -59.71 -71.3 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.129 1.372 . . . . 0.0 114.332 -169.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -98.55 -57.42 2.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.565 ' CD1' ' H ' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -79.07 146.57 67.93 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.147 1.779 . . . . 0.0 113.356 -176.42 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -82.9 171.72 11.53 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 124.182 3.255 . . . . 0.0 112.153 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.287 0 C-N-CA 125.499 1.52 . . . . 0.0 111.931 175.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.904 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 52.4 t30 58.05 48.28 13.4 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.98 1.712 . . . . 0.0 114.966 175.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -64.27 -20.54 66.13 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.117 167.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t 102.79 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 129.525 3.13 . . . . 0.0 116.975 166.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.7 -39.73 68.47 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.391 -1.443 . . . . 0.0 111.287 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.424 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 4.4 ptpt -77.08 1.65 17.45 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -127.08 6.84 6.53 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.084 1.354 . . . . 0.0 112.64 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 33.4 ttm -62.2 137.43 58.25 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.778 -1.201 . . . . 0.0 110.046 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 22.2 p -74.18 167.51 21.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.124 0.964 . . . . 0.0 111.727 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.73 -36.28 73.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.826 170.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -63.12 -36.96 85.35 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.161 0.891 . . . . 0.0 112.58 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -75.86 -38.72 57.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.941 0.896 . . . . 0.0 111.874 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -59.94 -45.38 92.81 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.189 -0.944 . . . . 0.0 113.08 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -71.45 -0.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 118.89 0.768 . . . . 0.0 112.665 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -119.03 -14.77 9.33 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 126.331 1.853 . . . . 0.0 114.949 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.64 159.15 13.8 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.956 1.253 . . . . 0.0 111.234 173.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -73.31 130.7 83.96 Favored Pre-proline 0 N--CA 1.482 1.151 0 O-C-N 120.72 -1.238 . . . . 0.0 110.263 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -58.18 -26.93 78.35 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 121.69 1.593 . . . . 0.0 114.445 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.502 ' HG3' ' H ' ' A' ' 4' ' ' SER . 6.5 mptt -56.7 -15.07 3.88 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 121.459 1.936 . . . . 0.0 114.604 175.612 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -123.38 21.37 9.51 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 122.791 2.541 . . . . 0.0 114.61 167.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 35.7 ttm -73.42 -57.84 3.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.44 1.496 . . . . 0.0 112.503 172.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.6 m -49.58 -52.35 51.11 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.35 -45.26 40.74 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.996 3.13 . . . . 0.0 115.792 172.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.2 p -75.63 -39.84 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 120.749 1.613 . . . . 0.0 112.785 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.82 -31.58 69.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.776 0.83 . . . . 0.0 111.252 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 37.5 t90 -83.06 -47.18 11.95 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.556 -1.211 . . . . 0.0 112.102 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.413 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -68.84 -24.1 64.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 121.208 1.822 . . . . 0.0 111.128 -170.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.09 -46.91 79.14 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.935 1.294 . . . . 0.0 111.51 169.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.33 -24.77 68.0 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.173 1.389 . . . . 0.0 113.187 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -119.31 54.03 1.0 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.091 2.156 . . . . 0.0 111.773 172.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -48.34 128.42 14.43 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 57.72 10.13 1.0 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.464 1.506 . . . . 0.0 114.536 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 53.67 -13.57 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.78 135.08 24.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 119.423 1.011 . . . . 0.0 111.976 -170.108 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.19 162.54 28.66 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -166.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -149.81 139.17 21.4 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.683 1.593 . . . . 0.0 111.503 -173.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 63.01 14.22 51.96 Favored Glycine 0 CA--C 1.542 1.731 0 N-CA-C 116.765 1.466 . . . . 0.0 116.765 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 173.19 -163.85 35.55 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.92 1.36 . . . . 0.0 113.952 -174.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -135.92 11.61 3.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.441 1.496 . . . . 0.0 114.863 -171.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 35.4 p -74.8 31.71 0.09 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 -169.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.43 -8.18 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 120.954 -1.091 . . . . 0.0 112.778 168.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.12 147.83 2.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.469 2.308 . . . . 0.0 113.288 173.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 39.7 tp -74.27 70.2 1.63 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.456 1.102 . . . . 0.0 110.028 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 18.8 p30 -72.34 174.0 7.94 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.042 2.137 . . . . 0.0 112.335 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.38 -27.16 65.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -172.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 18.6 m -65.31 -50.98 63.62 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.246 0.93 . . . . 0.0 109.739 169.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -59.46 -48.87 80.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.311 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 76.0 mt -52.82 -34.91 56.03 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.264 1.025 . . . . 0.0 113.009 174.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 58.7 m -75.72 -33.15 60.29 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.375 0.67 . . . . 0.0 111.596 175.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -81.03 -25.1 37.43 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 179.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.1 mm -54.42 -44.35 98.75 Favored Pre-proline 0 CA--C 1.555 1.161 0 CA-C-N 120.187 1.358 . . . . 0.0 112.173 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.98 -34.38 10.59 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.821 1.686 . . . . 0.0 113.204 171.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -66.1 -32.39 73.82 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.659 -1.276 . . . . 0.0 113.604 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.09 -25.9 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.663 0.665 . . . . 0.0 112.481 173.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.5 mt -73.62 -53.06 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.797 0.839 . . . . 0.0 109.546 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.42 -44.21 84.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.935 0.894 . . . . 0.0 112.184 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -71.44 -24.48 62.03 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.99 -1.069 . . . . 0.0 112.172 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.88 -46.01 22.57 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.118 -0.989 . . . . 0.0 112.055 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -26.03 68.59 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 120.28 1.4 . . . . 0.0 113.778 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -72.85 -32.34 65.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 168.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -129.34 60.51 51.62 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.22 1.408 . . . . 0.0 111.11 -175.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -60.17 -17.07 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.747 2.965 . . . . 0.0 115.424 -169.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -80.39 -18.01 50.18 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.668 1.187 . . . . 0.0 113.355 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -71.79 165.97 22.99 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.252 1.021 . . . . 0.0 112.429 -172.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -92.49 130.82 38.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 55.0 tp -46.71 -34.51 5.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.271 1.828 . . . . 0.0 114.092 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.424 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.2 m-85 -84.66 -8.71 58.77 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.6 p -62.81 -25.59 68.32 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.564 -1.335 . . . . 0.0 111.391 168.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -71.5 -2.98 18.7 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.28 1.432 . . . . 0.0 114.204 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -32.17 41.35 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.942 1.297 . . . . 0.0 111.277 167.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -72.44 -31.04 65.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.639 1.176 . . . . 0.0 112.431 -169.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -67.82 -30.0 69.3 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.701 1.6 . . . . 0.0 114.662 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -98.67 -38.55 9.07 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -167.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.9 m 61.42 -37.03 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 127.487 2.315 . . . . 0.0 116.263 -169.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 65.36 -174.17 0.18 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 128.482 2.713 . . . . 0.0 114.911 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -61.43 -34.38 75.3 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 -167.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.0 159.47 84.0 Favored Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.51 127.34 19.62 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 122.719 2.28 . . . . 0.0 110.478 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.201 0 C-N-CA 125.276 1.431 . . . . 0.0 111.878 -169.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 51.3 t30 57.14 46.14 19.5 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.109 1.764 . . . . 0.0 115.118 177.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -61.97 -22.9 66.04 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.411 167.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t 93.42 98.85 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.571 2.748 . . . . 0.0 117.217 165.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.27 -30.33 66.5 Favored 'General case' 0 CA--C 1.556 1.19 0 O-C-N 120.211 -1.556 . . . . 0.0 112.06 172.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 11.1 mtmt -64.91 -20.51 66.48 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.821 1.649 . . . . 0.0 114.869 173.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -114.5 7.36 16.17 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.035 1.334 . . . . 0.0 113.053 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -63.12 123.93 19.85 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.68 -1.263 . . . . 0.0 109.771 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.62 155.35 29.62 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.156 -0.965 . . . . 0.0 110.379 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -63.5 -33.46 75.64 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 120.247 -1.533 . . . . 0.0 113.291 -174.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.13 -32.99 73.64 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 171.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -78.93 -36.42 41.8 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.123 1.369 . . . . 0.0 111.774 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.09 -49.31 78.17 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.402 -0.811 . . . . 0.0 112.502 177.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -68.51 -2.54 2.03 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 124.743 1.217 . . . . 0.0 112.856 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -113.49 -11.1 13.12 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.872 1.669 . . . . 0.0 113.826 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.23 155.64 38.32 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 121.116 -0.99 . . . . 0.0 110.726 172.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -68.36 132.82 91.35 Favored Pre-proline 0 N--CA 1.48 1.043 0 O-C-N 121.052 -1.03 . . . . 0.0 111.231 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -45.49 -35.42 12.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.304 3.336 . . . . 0.0 114.466 175.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' B' ' 83' ' ' SER . 38.7 mttt -61.2 -19.06 61.17 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -127.52 19.53 6.78 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.655 1.57 . . . . 0.0 114.207 166.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 47.6 mtp -65.79 -58.73 4.95 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.784 0.833 . . . . 0.0 111.961 168.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 m -40.96 -55.31 4.86 Favored Pre-proline 0 N--CA 1.494 1.755 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -58.04 -39.43 85.9 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 123.791 2.994 . . . . 0.0 115.806 175.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.8 -38.4 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.807 1.185 . . . . 0.0 112.632 174.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.96 -21.35 66.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.303 1.041 . . . . 0.0 111.573 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.452 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 70.9 t90 -92.36 -49.12 6.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 116.986 -1.483 . . . . 0.0 112.973 168.602 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -69.27 -22.87 63.79 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 121.744 2.065 . . . . 0.0 112.512 -169.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.0 tmm? -70.76 -34.42 71.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.327 -0.858 . . . . 0.0 111.592 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -42.58 32.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.953 1.701 . . . . 0.0 111.99 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 -119.27 107.51 13.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.967 1.307 . . . . 0.0 107.935 166.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -65.16 174.37 2.05 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 121.056 0.455 . . . . 0.0 111.978 176.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.96 13.4 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 174.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.6 t -59.53 136.46 57.99 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.447 1.499 . . . . 0.0 111.944 -177.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.5 t -71.64 129.64 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.05 157.85 37.03 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -167.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -142.9 143.67 32.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.836 1.654 . . . . 0.0 111.852 -169.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.48 31.54 Favored Glycine 0 CA--C 1.544 1.905 0 C-N-CA 124.586 1.088 . . . . 0.0 115.466 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.78 -160.75 29.86 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 126.797 2.141 . . . . 0.0 111.01 -172.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -134.31 16.78 3.73 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -169.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 p -76.54 41.93 0.27 Allowed 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -169.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -21.55 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.0 1.32 . . . . 0.0 112.658 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -39.04 141.34 0.31 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.423 2.689 . . . . 0.0 113.695 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 35.1 tp -63.02 99.74 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 168.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -108.78 173.35 6.36 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.371 1.468 . . . . 0.0 112.023 -169.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.38 -26.88 68.2 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.221 -1.549 . . . . 0.0 113.565 -169.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 95.3 m -62.49 -43.18 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.362 -0.836 . . . . 0.0 110.262 168.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.25 -40.58 90.27 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 121.286 -0.884 . . . . 0.0 110.97 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.76 -23.03 66.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.376 0.989 . . . . 0.0 111.433 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.0 m -79.43 -37.3 37.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.055 0.942 . . . . 0.0 111.529 169.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -85.96 -27.06 25.14 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.26 -42.07 89.46 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-N 120.455 1.48 . . . . 0.0 112.385 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.58 -37.79 6.79 Favored 'Trans proline' 0 C--N 1.355 0.911 0 CA-C-N 121.97 1.739 . . . . 0.0 113.186 169.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt -66.81 -32.67 74.1 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.225 -1.547 . . . . 0.0 113.839 -176.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.7 m -69.07 -20.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 119.011 0.823 . . . . 0.0 112.949 173.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.0 mt -83.95 -51.04 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.043 0.937 . . . . 0.0 110.023 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.45 -38.84 78.34 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.152 0.981 . . . . 0.0 111.969 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.94 -30.28 68.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.556 0.616 . . . . 0.0 111.305 177.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -76.62 -42.51 42.02 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 120.934 -1.104 . . . . 0.0 113.072 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.71 -29.62 68.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 120.877 1.671 . . . . 0.0 113.914 177.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -80.11 -29.19 38.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -129.81 70.74 82.13 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.521 1.528 . . . . 0.0 111.121 174.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -59.53 -11.74 15.02 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.859 3.706 . . . . 0.0 116.254 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -83.69 -21.48 32.37 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.355 1.462 . . . . 0.0 113.146 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -69.1 157.4 36.91 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.113 0.965 . . . . 0.0 111.49 -174.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -94.39 134.54 36.78 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.8 tp -51.85 -38.85 57.54 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -168.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.448 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 5.2 m-85 -79.6 -5.88 55.92 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.7 p -61.41 -27.58 68.64 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.043 -1.661 . . . . 0.0 110.948 167.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.41 -2.91 24.28 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.417 1.487 . . . . 0.0 113.487 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -31.48 37.53 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.548 1.539 . . . . 0.0 111.714 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -70.22 -26.66 63.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.742 1.217 . . . . 0.0 112.198 -171.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -79.34 -31.16 42.98 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.763 1.625 . . . . 0.0 115.056 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.79 93.55 4.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.614 1.165 . . . . 0.0 113.602 -167.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.2 m -88.99 39.87 0.95 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.212 1.405 . . . . 0.0 114.768 -171.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -80.67 4.66 18.0 Favored 'General case' 0 CA--C 1.552 1.019 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.59 18.38 0.1 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 116.255 1.946 . . . . 0.0 116.255 -168.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -163.32 153.27 13.15 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 126.057 1.743 . . . . 0.0 112.03 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.8 157.57 60.58 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 122.096 1.864 . . . . 0.0 110.508 165.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.369 1.468 . . . . 0.0 112.835 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.837 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -163.05 118.7 1.77 Allowed 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.707 1.241 . . . . 0.0 108.275 168.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.73 -163.22 0.94 Allowed 'General case' 0 N--CA 1.427 -1.616 0 C-N-CA 129.208 3.003 . . . . 0.0 107.719 -166.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 83' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 19' ' ' LYS . 20.2 m -137.03 56.53 1.79 Allowed 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 124.032 0.933 . . . . 0.0 109.26 168.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.68 -39.79 68.45 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.546 -1.347 . . . . 0.0 109.677 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.452 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 2.4 ptpt -68.18 -6.31 22.69 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.449 2.699 . . . . 0.0 116.527 175.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -138.42 18.4 2.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.495 1.518 . . . . 0.0 112.143 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 87' ' ' MET . . . . . 0.428 ' HE1' HD22 ' B' ' 95' ' ' LEU . 23.4 ttm -60.09 123.76 18.13 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 120.023 1.283 . . . . 0.0 108.143 177.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.8 t -76.6 152.15 36.0 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.065 -175.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.195 -1.566 . . . . 0.0 112.763 -170.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -32.42 71.92 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 119.34 0.973 . . . . 0.0 112.38 173.5 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.41 -37.3 63.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.538 1.535 . . . . 0.0 111.231 174.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -64.01 -49.75 71.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.652 1.181 . . . . 0.0 113.203 175.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.0 pt -68.66 -3.88 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 176.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -103.78 -10.13 18.51 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.073 1.749 . . . . 0.0 114.053 169.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 95' ' ' LEU . . . . . 0.428 HD22 ' HE1' ' B' ' 87' ' ' MET . 0.2 OUTLIER -70.77 160.76 32.11 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.702 -1.249 . . . . 0.0 110.464 171.006 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.448 HD21 ' HD2' ' B' ' 98' ' ' LYS . 53.8 t-20 -69.44 130.47 90.75 Favored Pre-proline 0 N--CA 1.481 1.122 0 O-C-N 121.376 -0.827 . . . . 0.0 111.942 -178.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.13 -19.95 35.79 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.57 2.847 . . . . 0.0 115.614 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.448 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.8 mttt -55.81 -66.19 0.47 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.487 1.915 . . . . 0.0 110.386 168.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.37 -6.57 59.4 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.6 ttm -58.37 -38.02 76.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.97 -1.081 . . . . 0.0 111.313 168.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 63.3 m -60.48 -56.75 32.21 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 124.346 1.058 . . . . 0.0 112.598 -177.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -52.85 -44.61 46.95 Favored 'Trans proline' 0 C--N 1.357 1.001 0 C-N-CA 124.187 3.258 . . . . 0.0 115.408 171.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.21 -37.21 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 120.442 1.474 . . . . 0.0 112.896 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.79 -24.93 67.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.629 0.771 . . . . 0.0 110.975 175.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.505 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.4 t90 -83.14 -51.16 7.75 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.496 168.591 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.505 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.3 t90 -64.98 -33.55 76.31 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.673 1.579 . . . . 0.0 111.278 -168.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -57.17 -44.24 83.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.734 1.214 . . . . 0.0 112.352 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -33.33 75.62 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.294 1.438 . . . . 0.0 111.909 -173.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -98.68 -10.44 23.22 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 46.83 -72.01 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 130.141 3.377 . . . . 0.0 116.22 -168.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.79 137.25 56.49 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.783 0.801 . . . . 0.0 111.729 -167.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 10.6 p -66.87 -2.32 5.03 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -178.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.3 p -134.93 148.04 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 126.084 1.754 . . . . 0.0 110.96 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -79.84 159.97 26.27 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.41 1.084 . . . . 0.0 113.123 -177.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 152.8 41.35 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.151 1.381 . . . . 0.0 111.578 -168.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.32 -95.88 0.38 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.141 0.877 . . . . 0.0 111.549 -177.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.58 -163.28 23.33 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.519 1.057 . . . . 0.0 113.151 169.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -127.24 11.47 6.96 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.396 1.478 . . . . 0.0 114.214 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 3.9 m -78.25 61.39 2.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.338 1.455 . . . . 0.0 112.549 -172.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 7.0 t -59.02 -25.45 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.607 1.163 . . . . 0.0 111.695 175.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.86 138.34 19.02 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.658 1.183 . . . . 0.0 111.87 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 93.4 mt -67.05 126.23 28.52 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.523 -0.736 . . . . 0.0 110.871 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -95.15 166.71 11.78 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.025 1.33 . . . . 0.0 109.635 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.1 -30.16 71.37 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.72 -1.237 . . . . 0.0 112.432 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 89.3 m -64.98 -41.72 95.19 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.421 -0.799 . . . . 0.0 111.863 169.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -63.52 -47.68 80.67 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.107 1.321 . . . . 0.0 110.174 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.8 mt -58.13 -30.5 66.38 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.251 1.02 . . . . 0.0 112.515 175.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 91.2 m -80.29 -37.19 33.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.587 1.155 . . . . 0.0 112.104 174.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -74.15 -31.88 62.9 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.519 -1.363 . . . . 0.0 113.602 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.59 -51.84 75.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 120.068 1.304 . . . . 0.0 112.208 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.64 -33.19 36.48 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 CA-C-N 121.922 1.722 . . . . 0.0 113.5 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -62.99 -41.43 99.57 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.625 1.557 . . . . 0.0 113.008 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.44 -28.35 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.832 -0.542 . . . . 0.0 112.427 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 54.6 mt -67.23 -47.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.302 0.501 . . . . 0.0 110.318 172.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -57.99 -44.31 87.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.857 0.863 . . . . 0.0 111.624 172.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.73 -23.45 63.2 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.942 -1.099 . . . . 0.0 113.173 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.34 -51.12 8.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.626 1.103 . . . . 0.0 112.434 175.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -26.65 68.51 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 120.614 1.552 . . . . 0.0 113.508 173.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -73.02 -29.79 63.27 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.467 1.507 . . . . 0.0 114.663 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -131.63 64.87 74.45 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.51 -15.35 40.73 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.851 3.034 . . . . 0.0 116.483 -168.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -84.33 -12.84 53.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.561 1.144 . . . . 0.0 114.051 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -77.48 163.54 26.24 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.726 1.21 . . . . 0.0 112.529 -170.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -79.18 143.89 34.97 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.837 -0.54 . . . . 0.0 109.813 169.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.78 -39.51 85.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.452 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 3.0 m-30 -82.65 -26.7 31.92 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.9 t -61.58 -19.18 61.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.903 -1.123 . . . . 0.0 112.187 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.68 -4.19 1.9 Allowed 'General case' 0 CA--C 1.538 0.518 0 O-C-N 119.554 -1.966 . . . . 0.0 113.957 171.076 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -33.68 71.58 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.554 1.07 . . . . 0.0 111.965 166.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.01 -32.42 73.78 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -167.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 151' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' B' ' 151' ' ' GLN . 8.3 pt20 -71.06 -28.2 64.19 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.744 2.018 . . . . 0.0 115.154 172.274 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -91.71 131.8 36.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -167.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 82.0 p -129.44 6.72 5.28 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 -176.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -67.7 132.85 48.25 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -169.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 13.9 t70 59.37 -31.85 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 129.635 3.174 . . . . 0.0 117.708 172.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.1 pp -64.88 148.93 97.09 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 126.069 1.748 . . . . 0.0 112.104 173.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.17 155.25 52.08 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.304 2.669 . . . . 0.0 113.013 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.975 1.71 . . . . 0.0 111.834 177.56 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 120.545 0.212 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -160.73 116.5 2.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 123.037 1.399 . . . . 0.0 108.379 168.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.553 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER -166.67 -176.93 3.7 Favored 'General case' 0 N--CA 1.422 -1.852 0 C-N-CA 130.048 3.339 . . . . 0.0 106.323 -165.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.429 ' H ' ' HG2' ' B' ' 98' ' ' LYS . 17.3 m -128.94 57.58 1.62 Allowed 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 123.402 0.681 . . . . 0.0 109.947 169.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.553 ' H ' ' HG2' ' A' ' 3' ' ' GLU . . . -53.35 -40.64 65.08 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.166 1.348 . . . . 0.0 109.414 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.469 ' HA ' ' CD2' ' A' ' 67' ' ' TYR . 3.0 mppt? -45.39 -29.03 0.97 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 130.592 3.557 . . . . 0.0 114.893 169.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -134.77 21.99 3.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.963 1.705 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.526 ' HE1' HD22 ' A' ' 16' ' ' LEU . 20.4 ttm -60.05 120.02 8.91 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.3 t -74.97 152.1 38.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -173.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.35 -28.4 69.26 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.624 -1.297 . . . . 0.0 113.165 -170.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.41 90.94 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.886 0.766 . . . . 0.0 111.595 169.248 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -70.47 -37.14 74.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.257 1.023 . . . . 0.0 111.949 175.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -59.38 -52.29 66.27 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.349 -0.845 . . . . 0.0 112.812 174.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.2 pt -69.87 0.93 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 112.627 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -112.61 -14.76 13.14 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.072 1.749 . . . . 0.0 114.02 173.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.526 HD22 ' HE1' ' A' ' 8' ' ' MET . 0.3 OUTLIER -67.03 162.72 21.51 Favored 'General case' 0 CA--C 1.552 1.049 0 O-C-N 120.88 -1.137 . . . . 0.0 110.127 169.778 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.519 HD21 ' HD3' ' A' ' 19' ' ' LYS . 50.4 t-20 -68.22 129.93 92.68 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 120.823 -1.173 . . . . 0.0 112.409 -175.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 38.8 Cg_exo -58.81 -12.31 14.45 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.269 3.312 . . . . 0.0 116.15 176.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.519 ' HD3' HD21 ' A' ' 17' ' ' ASN . 7.6 mttt -65.37 -63.06 1.19 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.334 1.854 . . . . 0.0 108.669 166.579 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.62 0.92 44.75 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 72.8 mtp -59.54 -38.5 81.22 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.818 -1.176 . . . . 0.0 112.116 169.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 21.8 m -66.64 -51.53 39.97 Favored Pre-proline 0 N--CA 1.48 1.045 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -49.5 -46.75 25.32 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.66 2.907 . . . . 0.0 116.132 169.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.09 -39.65 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 120.954 -1.091 . . . . 0.0 112.765 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.12 -27.33 68.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.558 0.743 . . . . 0.0 111.803 173.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 81.1 t90 -83.43 -52.21 6.72 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.727 171.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.434 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.4 t90 -66.05 -34.63 78.53 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 120.213 1.37 . . . . 0.0 111.517 -168.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -56.58 -42.83 79.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.988 1.315 . . . . 0.0 111.731 171.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.6 -18.99 65.73 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.679 1.592 . . . . 0.0 113.788 175.395 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -108.18 -7.66 15.96 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 57.87 13.74 2.24 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 125.752 1.621 . . . . 0.0 115.108 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 49.26 30.91 3.36 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.207 1.403 . . . . 0.0 112.269 -166.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.8 t -69.53 -9.61 54.62 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -171.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.257 0.4 OUTLIER 65.05 152.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 127.404 2.282 . . . . 0.0 113.487 -170.416 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -85.36 137.14 33.14 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.912 0.885 . . . . 0.0 111.93 -177.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -150.8 146.48 26.4 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.205 1.402 . . . . 0.0 111.25 -169.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.57 -77.6 0.26 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.183 0.896 . . . . 0.0 111.343 -170.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.68 177.37 54.39 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.624 1.106 . . . . 0.0 112.35 168.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -143.14 16.89 1.91 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 42' ' ' THR . 7.3 p -65.74 -51.9 55.46 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -173.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t 61.58 -20.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 125.658 1.583 . . . . 0.0 114.602 -169.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.447 ' H ' ' C ' ' A' ' 40' ' ' THR . 43.0 p -44.48 149.46 0.39 Allowed 'General case' 0 C--O 1.238 0.487 0 C-N-CA 128.314 2.646 . . . . 0.0 114.738 -175.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mt -70.86 73.47 0.58 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 122.733 1.254 . . . . 0.0 109.434 165.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -66.0 167.9 9.08 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.506 2.723 . . . . 0.0 112.117 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -68.13 -22.67 64.87 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.667 -1.271 . . . . 0.0 114.304 -172.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.9 m -65.55 -49.97 66.93 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.218 0.917 . . . . 0.0 110.141 169.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -55.99 -51.83 66.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.804 0.729 . . . . 0.0 110.779 173.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -61.11 -30.63 70.47 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.41 0.684 . . . . 0.0 112.234 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.1 m -73.78 -38.29 64.71 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.375 0.67 . . . . 0.0 111.39 173.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -82.07 -24.22 35.37 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.667 -175.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.2 mm -52.49 -48.66 89.28 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 120.504 1.502 . . . . 0.0 111.79 177.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.4 -37.59 22.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 CA-C-N 121.484 1.566 . . . . 0.0 113.342 172.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.05 -37.02 84.78 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.671 -1.268 . . . . 0.0 113.292 -175.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.14 -22.19 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.7 mt -81.09 -50.95 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.562 0.745 . . . . 0.0 110.116 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -59.54 -39.61 84.52 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.08 0.952 . . . . 0.0 112.008 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.75 -30.33 70.52 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 122.952 0.501 . . . . 0.0 111.373 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.68 -46.89 28.74 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 174.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -29.97 68.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 121.094 1.77 . . . . 0.0 114.145 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.88 -34.52 60.0 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -132.04 78.08 70.1 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.506 1.123 . . . . 0.0 111.932 171.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -54.58 -12.57 4.49 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.844 3.696 . . . . 0.0 117.462 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.32 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.229 1.412 . . . . 0.0 112.817 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -66.07 159.5 25.91 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 113.1 -171.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -84.13 138.84 32.81 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.636 -0.665 . . . . 0.0 109.389 169.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.22 -34.33 66.21 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 172.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -85.36 -29.66 24.28 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 115.558 1.688 . . . . 0.0 115.558 -173.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.7 t -64.28 -12.48 41.94 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.11 -0.994 . . . . 0.0 112.078 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -66.34 -3.69 6.46 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 119.662 -1.899 . . . . 0.0 113.737 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 -30.55 32.94 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.431 1.492 . . . . 0.0 111.955 167.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -66.68 -28.52 68.52 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.11 1.364 . . . . 0.0 112.074 -173.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.05 -30.01 55.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 114.79 173.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -108.84 97.86 7.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -166.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -75.48 104.74 6.16 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 167.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -80.16 178.19 8.42 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.7 0.8 . . . . 0.0 112.211 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.82 47.31 0.41 Allowed 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.515 1.926 . . . . 0.0 114.24 -173.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -150.02 159.1 36.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 127.275 2.23 . . . . 0.0 112.263 -178.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -69.83 159.63 52.67 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.058 2.505 . . . . 0.0 112.424 169.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.326 1.05 . . . . 0.0 112.071 173.186 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.959 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 50.3 t30 58.91 49.7 9.39 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.691 1.597 . . . . 0.0 114.294 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.56 -19.59 62.34 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.729 0.812 . . . . 0.0 112.968 168.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 11.6 t 103.98 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 129.552 3.141 . . . . 0.0 114.343 169.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -33.7 71.84 Favored 'General case' 0 CA--C 1.554 1.099 0 O-C-N 120.522 -1.361 . . . . 0.0 110.711 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -41.25 74.95 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.104 2.162 . . . . 0.0 113.454 173.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.77 8.16 39.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.066 1.347 . . . . 0.0 113.297 -174.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.0 ttm -62.59 123.08 17.43 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 109.904 172.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -77.78 155.34 31.2 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.041 -1.037 . . . . 0.0 110.494 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.84 -32.84 74.14 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.274 -1.516 . . . . 0.0 112.984 -174.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.85 -31.65 72.9 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.871 0.76 . . . . 0.0 112.871 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -80.18 -36.63 34.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.306 1.443 . . . . 0.0 111.357 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -61.45 -48.55 80.64 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.784 0.834 . . . . 0.0 112.611 175.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.45 -1.43 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 123.73 0.812 . . . . 0.0 113.163 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -110.56 -9.29 14.56 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.38 1.872 . . . . 0.0 114.076 172.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 155.72 40.08 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 119.875 1.216 . . . . 0.0 110.702 174.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -67.75 130.84 92.84 Favored Pre-proline 0 N--CA 1.479 0.982 0 O-C-N 121.292 -0.88 . . . . 0.0 110.624 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -46.58 -35.06 16.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.193 3.262 . . . . 0.0 114.117 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.429 ' HG2' ' H ' ' A' ' 4' ' ' SER . 59.3 mttt -60.39 -14.8 20.85 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -132.92 19.01 4.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.891 1.678 . . . . 0.0 112.609 166.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.1 ttm -70.0 -52.01 27.68 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.802 1.241 . . . . 0.0 110.88 169.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 2.7 m -45.76 -56.62 9.63 Favored Pre-proline 0 N--CA 1.489 1.519 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.88 -43.29 58.49 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.052 3.168 . . . . 0.0 115.389 175.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.39 -38.3 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.184 1.356 . . . . 0.0 112.724 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.04 -26.99 68.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.99 0.916 . . . . 0.0 111.042 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.507 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.7 t90 -84.01 -52.87 5.97 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.294 168.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.507 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.8 t90 -64.33 -31.18 72.28 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 120.048 1.295 . . . . 0.0 112.683 -166.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -61.61 -49.31 77.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.592 1.157 . . . . 0.0 111.406 172.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.73 -28.63 65.96 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.492 1.517 . . . . 0.0 111.802 -177.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -153.34 94.58 1.83 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.91 1.684 . . . . 0.0 109.635 -171.011 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -71.41 166.73 21.07 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 -171.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' GLU . . . . . 0.404 ' HB3' ' HE1' ' B' ' 106' ' ' TRP . 0.0 OUTLIER -69.38 18.68 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 O-C-N 120.689 -1.257 . . . . 0.0 114.347 168.811 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 14.5 t -58.66 149.25 26.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.987 1.315 . . . . 0.0 112.207 -178.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.34 120.57 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 123.921 0.888 . . . . 0.0 109.232 -176.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.94 160.02 21.16 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 116.029 1.863 . . . . 0.0 116.029 -166.086 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -152.57 149.37 28.42 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.658 1.583 . . . . 0.0 112.231 -170.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.09 3.63 31.27 Favored Glycine 0 CA--C 1.539 1.568 0 N-CA-C 117.167 1.627 . . . . 0.0 117.167 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 169.82 -160.26 33.23 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.893 1.346 . . . . 0.0 113.307 -176.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -130.4 17.25 5.42 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.828 1.651 . . . . 0.0 114.065 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 12.0 p -72.81 37.18 0.08 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 127.066 2.146 . . . . 0.0 115.726 -170.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.7 m -78.93 -12.89 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 120.514 -1.366 . . . . 0.0 113.947 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.98 168.41 11.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.403 1.481 . . . . 0.0 110.901 167.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 40.0 mt -63.18 115.97 4.99 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.986 -1.071 . . . . 0.0 110.625 168.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -92.54 173.27 7.87 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.065 1.346 . . . . 0.0 111.193 175.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.04 -36.61 73.0 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.431 -0.793 . . . . 0.0 112.385 177.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 42.4 m -65.28 -43.58 90.74 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.573 -0.704 . . . . 0.0 111.519 172.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -66.05 -51.82 54.71 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.997 -1.064 . . . . 0.0 111.36 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.72 -23.13 65.94 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -82.96 -33.26 26.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 119.284 -0.388 . . . . 0.0 112.021 172.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.64 -27.38 29.16 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.01 -42.43 85.29 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 120.599 1.545 . . . . 0.0 113.495 176.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.39 -35.07 5.23 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 CA-C-N 122.438 1.906 . . . . 0.0 113.476 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -66.69 -32.12 73.23 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.261 -1.525 . . . . 0.0 113.42 -176.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.26 -29.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.721 -0.612 . . . . 0.0 112.122 172.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -71.26 -49.42 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.47 0.708 . . . . 0.0 110.151 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -57.56 -41.69 81.52 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.426 0.69 . . . . 0.0 111.995 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -67.94 -34.67 77.04 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 118.986 0.812 . . . . 0.0 112.295 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.14 -44.62 68.48 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.263 -0.898 . . . . 0.0 112.413 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -29.29 65.35 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.446 1.475 . . . . 0.0 114.865 179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -76.38 -27.44 56.39 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 170.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -132.97 73.05 76.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.019 1.328 . . . . 0.0 111.636 172.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -59.22 -11.57 13.53 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.037 3.158 . . . . 0.0 116.279 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -81.37 -23.19 37.85 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.78 1.632 . . . . 0.0 113.916 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -65.33 157.54 28.87 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.831 1.252 . . . . 0.0 111.279 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -96.07 133.61 40.12 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 118.322 -0.847 . . . . 0.0 109.289 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.8 tp -50.62 -38.52 46.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -168.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.273 4.8 m-85 -82.33 -1.02 48.36 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -177.335 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 62.4 p -64.99 -32.15 73.73 Favored 'General case' 0 N--CA 1.483 1.214 0 O-C-N 120.582 -1.324 . . . . 0.0 110.925 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -69.73 -1.87 10.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.415 1.486 . . . . 0.0 113.649 -176.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -77.7 -38.7 46.82 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.84 1.656 . . . . 0.0 112.244 167.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -27.62 64.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -167.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -70.28 -29.2 65.9 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.018 1.727 . . . . 0.0 114.581 170.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.89 -45.96 4.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -167.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 47.9 m 46.61 40.74 8.9 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -84.17 5.41 26.44 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -172.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -80.52 24.26 0.47 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.421 1.888 . . . . 0.0 114.695 -172.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -160.7 149.7 13.65 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.271 2.229 . . . . 0.0 110.105 171.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.73 160.84 48.1 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.536 2.824 . . . . 0.0 112.478 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.0 t30 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 125.751 1.62 . . . . 0.0 111.239 178.913 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.321 9.2 t-20 69.87 34.05 2.69 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 172.155 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -74.67 158.38 33.72 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.951 2.1 . . . . 0.0 106.226 163.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.8 t -99.37 92.69 5.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.699 1.2 . . . . 0.0 113.073 -165.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.13 -31.28 67.03 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.524 -1.36 . . . . 0.0 111.359 176.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.2 ptpt -74.52 -10.2 59.32 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 177.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -121.03 14.78 11.52 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.049 1.339 . . . . 0.0 111.821 168.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.42 118.95 7.62 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.855 -1.153 . . . . 0.0 108.016 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -76.53 154.87 34.18 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.176 -0.953 . . . . 0.0 109.672 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.15 -32.64 74.07 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.455 -1.403 . . . . 0.0 113.197 -172.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -62.82 -33.77 75.91 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 170.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -77.12 -37.16 54.67 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.071 1.349 . . . . 0.0 111.361 175.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -60.0 -50.15 74.88 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 121.469 -0.769 . . . . 0.0 112.353 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.8 pt -69.41 -2.84 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 124.561 1.144 . . . . 0.0 112.981 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -106.02 -12.11 15.91 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.249 1.42 . . . . 0.0 113.738 172.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.59 165.87 23.85 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.119 0.968 . . . . 0.0 110.474 170.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.509 HD21 ' HD3' ' A' ' 19' ' ' LYS . 48.8 t-20 -72.34 131.98 84.43 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.786 -1.196 . . . . 0.0 111.74 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.1 -30.67 41.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.229 3.286 . . . . 0.0 116.077 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.509 ' HD3' HD21 ' A' ' 17' ' ' ASN . 8.2 mttt -51.5 -59.28 4.43 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.456 1.902 . . . . 0.0 108.893 169.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 178.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 78.0 mtp -61.85 -35.38 78.1 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.065 1.302 . . . . 0.0 111.343 169.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 28.2 m -64.38 -54.15 40.36 Favored Pre-proline 0 N--CA 1.48 1.048 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -175.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -52.46 -39.04 75.11 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 123.493 2.796 . . . . 0.0 116.094 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.8 p -78.03 -34.56 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.61 1.095 . . . . 0.0 113.491 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -24.67 67.93 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.334 1.053 . . . . 0.0 110.62 172.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.516 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 68.7 t90 -85.74 -56.46 3.48 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 117.939 -1.029 . . . . 0.0 112.612 168.118 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.6 t90 -64.88 -28.99 69.92 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 120.655 1.571 . . . . 0.0 112.759 -166.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -61.42 -52.12 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.338 1.055 . . . . 0.0 111.357 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -26.58 65.87 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.839 1.656 . . . . 0.0 111.955 -175.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -111.28 6.33 20.47 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 62.13 144.74 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 128.285 2.634 . . . . 0.0 117.019 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.3 -3.74 38.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.1 p -87.06 -98.95 0.08 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.718 1.207 . . . . 0.0 112.206 -170.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -158.54 147.24 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 125.063 1.345 . . . . 0.0 109.357 -171.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -82.04 31.96 0.38 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 116.107 1.892 . . . . 0.0 116.107 -168.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt 59.33 17.91 6.25 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.234 1.814 . . . . 0.0 115.022 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.19 -0.33 88.79 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 125.478 1.513 . . . . 0.0 114.991 -173.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.38 171.57 55.14 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 119.091 1.446 . . . . 0.0 112.817 169.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -119.67 -23.9 6.39 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.28 5.8 t -82.84 54.48 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 123.043 1.402 . . . . 0.0 112.896 -171.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.06 -12.87 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 124.702 1.201 . . . . 0.0 112.481 170.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.05 144.8 27.65 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.276 1.831 . . . . 0.0 112.532 174.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 29.4 mt -84.32 151.59 24.65 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.441 1.115 . . . . 0.0 112.749 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -143.51 168.74 19.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.547 2.339 . . . . 0.0 109.214 -168.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.96 -24.02 66.72 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -169.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 m -63.63 -48.15 78.47 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.35 0.977 . . . . 0.0 110.569 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -64.35 -41.68 96.63 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.412 -0.805 . . . . 0.0 110.973 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.2 mt -65.11 -24.01 67.31 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.778 -0.576 . . . . 0.0 112.541 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.9 m -80.01 -33.4 39.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.922 1.289 . . . . 0.0 111.319 172.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.4 mm100 -82.64 -30.33 29.44 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.729 1.149 . . . . 0.0 113.249 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.7 -41.84 85.98 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 120.277 1.399 . . . . 0.0 113.423 175.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.1 -36.58 7.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 122.392 1.89 . . . . 0.0 113.429 169.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -66.17 -35.15 79.7 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.778 1.626 . . . . 0.0 113.817 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.03 -17.45 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 174.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -88.68 -52.09 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.255 1.022 . . . . 0.0 110.904 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.91 -42.17 71.88 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.082 0.953 . . . . 0.0 110.947 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.15 -30.7 70.76 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.049 -0.407 . . . . 0.0 111.403 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.9 m -74.68 -45.12 46.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.101 -0.952 . . . . 0.0 113.199 174.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.8 69.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 120.883 1.674 . . . . 0.0 114.166 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -82.2 -26.55 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -130.75 75.02 79.42 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 125.606 1.563 . . . . 0.0 110.912 170.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -60.75 -11.28 16.95 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.799 3.666 . . . . 0.0 115.871 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -80.28 -25.37 39.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.832 1.653 . . . . 0.0 112.782 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -69.96 160.51 31.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.43 1.492 . . . . 0.0 111.955 -172.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.62 146.92 26.64 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.561 -0.712 . . . . 0.0 110.058 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 57.1 tp -61.97 -31.63 72.0 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.263 -0.898 . . . . 0.0 113.219 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 2.4 m-85 -89.62 -24.87 21.56 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 -171.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -63.02 -15.43 56.43 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.863 -1.148 . . . . 0.0 112.071 171.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -66.26 -5.89 11.95 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.513 -1.992 . . . . 0.0 113.743 169.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -34.51 60.57 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.44 1.496 . . . . 0.0 111.606 167.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -62.96 -25.13 68.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.176 1.79 . . . . 0.0 112.774 -170.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -85.08 -30.89 23.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.423 1.889 . . . . 0.0 115.955 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.19 -52.39 5.09 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 -166.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.2 m 44.9 30.42 0.56 Allowed 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -85.22 -9.5 57.7 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.87 1.268 . . . . 0.0 114.089 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -94.58 39.4 1.09 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.812 3.245 . . . . 0.0 116.054 -167.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.22 152.82 19.03 Favored Pre-proline 0 CA--C 1.547 0.838 0 O-C-N 121.481 -0.762 . . . . 0.0 113.014 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -66.01 160.63 43.48 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.93 2.42 . . . . 0.0 111.876 168.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.478 1.511 . . . . 0.0 113.518 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.944 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 58.9 t-20 68.09 -69.1 0.15 Allowed 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 128.917 2.887 . . . . 0.0 111.881 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.258 50.1 mm-40 58.22 -26.77 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 -175.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 101.42 93.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 131.14 3.776 . . . . 0.0 115.008 169.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.14 -34.17 69.97 Favored 'General case' 0 CA--C 1.555 1.136 0 O-C-N 120.383 -1.448 . . . . 0.0 110.641 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.452 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 15.5 mtmt -58.4 -34.75 71.09 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.3 1.84 . . . . 0.0 114.538 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -105.44 8.73 33.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.914 1.285 . . . . 0.0 112.976 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.9 ttm -62.38 123.79 19.2 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.635 1.107 . . . . 0.0 109.662 171.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -76.32 154.7 34.83 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 121.015 -1.053 . . . . 0.0 110.307 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.38 -31.95 73.24 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.162 -1.586 . . . . 0.0 113.187 -173.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -65.29 -32.49 74.17 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.155 0.889 . . . . 0.0 112.933 172.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -77.85 -37.35 48.58 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.303 1.441 . . . . 0.0 111.298 176.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -62.83 -47.69 82.33 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.547 -0.72 . . . . 0.0 112.75 176.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -69.76 -3.53 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -104.49 -10.61 17.54 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.043 1.737 . . . . 0.0 114.251 170.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.69 160.42 32.66 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 119.895 1.225 . . . . 0.0 110.895 173.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 50.3 t-20 -65.72 129.96 94.43 Favored Pre-proline 0 N--CA 1.48 1.062 0 O-C-N 121.118 -0.989 . . . . 0.0 111.571 -178.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 31.9 Cg_exo -60.43 -17.38 47.39 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.278 2.652 . . . . 0.0 114.783 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 mptt -54.69 -69.39 0.13 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.501 1.52 . . . . 0.0 109.889 168.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 99' ' ' ALA . . . . . 0.427 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -78.87 -11.53 60.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -175.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -54.58 -35.5 63.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 120.618 -1.302 . . . . 0.0 112.532 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 32.4 m -61.87 -57.8 21.93 Favored Pre-proline 0 N--CA 1.483 1.208 0 CA-C-O 117.719 -1.134 . . . . 0.0 113.542 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -53.95 -37.1 85.68 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.97 3.114 . . . . 0.0 114.244 169.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 103' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 99' ' ' ALA . 55.9 t -62.71 -50.14 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.562 -0.711 . . . . 0.0 111.534 174.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.11 -40.28 95.87 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.185 0.994 . . . . 0.0 109.897 -176.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.489 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 75.1 t90 -68.36 -49.65 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 116.991 -1.481 . . . . 0.0 112.592 172.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.85 -26.41 65.13 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 121.416 1.916 . . . . 0.0 111.268 -170.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -63.29 -48.83 76.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.385 1.074 . . . . 0.0 111.045 169.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.16 -31.67 72.97 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.865 1.266 . . . . 0.0 112.172 -179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.35 63.91 0.73 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 111.971 171.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -54.1 -42.04 68.93 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.047 1.339 . . . . 0.0 114.613 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.14 125.56 24.91 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.891 0.853 . . . . 0.0 111.915 -171.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 38.0 p -69.42 -4.08 17.02 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -175.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -133.59 147.16 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.313 1.045 . . . . 0.0 111.898 170.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -111.99 147.9 34.95 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -169.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -131.48 160.56 34.82 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.903 1.681 . . . . 0.0 112.419 -170.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.08 28.67 67.98 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.943 0.782 . . . . 0.0 113.576 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 107.42 -155.35 16.34 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.721 1.629 . . . . 0.0 111.822 -169.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -119.0 26.91 9.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 11.5 p -72.35 42.97 0.1 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.953 2.101 . . . . 0.0 115.015 -173.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 m -62.16 -13.45 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.629 1.172 . . . . 0.0 112.447 168.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.22 136.69 11.75 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.912 1.685 . . . . 0.0 110.734 169.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 8.6 mp -75.01 113.92 12.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.472 0.653 . . . . 0.0 110.414 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -76.86 168.18 20.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.777 1.631 . . . . 0.0 109.35 171.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -63.02 -26.84 69.04 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.561 -1.337 . . . . 0.0 112.376 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -45.4 91.26 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 121.419 -0.801 . . . . 0.0 111.493 168.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -64.38 -46.37 83.63 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.662 1.119 . . . . 0.0 110.265 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -59.31 -30.43 68.33 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.767 0.827 . . . . 0.0 112.423 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 86.8 m -78.75 -36.89 42.45 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.426 1.09 . . . . 0.0 111.625 174.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -78.66 -32.65 47.28 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.947 -1.095 . . . . 0.0 113.741 -176.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.41 -45.24 95.26 Favored Pre-proline 0 N--CA 1.481 1.087 0 CA-C-N 120.364 1.438 . . . . 0.0 113.09 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.69 -34.99 8.31 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 122.228 1.831 . . . . 0.0 113.277 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -66.19 -32.78 74.42 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.329 -1.482 . . . . 0.0 113.983 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 23.0 m -71.59 -27.19 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 121.798 -0.564 . . . . 0.0 111.878 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -72.3 -47.29 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.463 0.705 . . . . 0.0 110.131 170.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -57.88 -41.06 81.73 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.697 0.799 . . . . 0.0 112.075 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.73 -32.35 74.0 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.279 0.945 . . . . 0.0 112.263 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.37 -47.4 56.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.876 -1.14 . . . . 0.0 112.428 176.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.85 -29.02 66.17 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 120.555 1.525 . . . . 0.0 114.804 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -74.41 -28.53 61.11 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 170.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -134.21 73.91 68.63 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.073 1.349 . . . . 0.0 111.71 173.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -59.93 -11.11 14.02 Favored 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 124.018 3.145 . . . . 0.0 116.033 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -81.0 -22.63 39.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.929 1.692 . . . . 0.0 114.175 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -63.89 155.47 30.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.237 1.415 . . . . 0.0 111.085 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -91.33 133.73 35.19 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.8 tp -51.07 -39.01 55.05 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -168.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.452 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.7 m-85 -81.43 -5.54 58.01 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -176.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 77.0 p -59.22 -27.44 65.75 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.378 -1.451 . . . . 0.0 111.163 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -72.48 -2.48 19.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.209 1.404 . . . . 0.0 113.666 177.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -80.31 -32.06 38.06 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.747 1.158 . . . . 0.0 111.748 167.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -64.34 -26.62 68.56 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.201 1.0 . . . . 0.0 112.738 -169.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -77.01 -27.76 54.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.385 2.274 . . . . 0.0 116.149 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -103.22 113.47 26.98 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -166.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 31.1 m -121.03 37.59 4.28 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.364 1.466 . . . . 0.0 113.465 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -74.84 147.93 40.69 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -171.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 26.4 t70 60.04 -54.76 0.07 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 130.253 3.421 . . . . 0.0 118.137 170.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.06 150.59 74.94 Favored Pre-proline 0 CA--C 1.553 1.069 0 C-N-CA 124.432 1.093 . . . . 0.0 113.167 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -73.59 155.18 49.97 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.517 2.811 . . . . 0.0 112.487 175.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.244 0 C-N-CA 126.006 1.723 . . . . 0.0 110.986 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.892 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.4 t30 56.35 47.88 18.17 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.069 1.748 . . . . 0.0 115.034 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -62.71 -21.17 65.57 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.995 167.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.7 t 98.59 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 128.72 2.808 . . . . 0.0 117.361 164.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.9 -34.89 73.78 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 119.88 -1.763 . . . . 0.0 112.091 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -72.12 -4.42 28.93 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 175.09 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.65 5.15 11.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.501 1.52 . . . . 0.0 112.445 169.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.3 ttm -62.56 125.67 24.73 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.641 -1.287 . . . . 0.0 109.54 175.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.71 154.79 29.8 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.402 -0.811 . . . . 0.0 110.496 179.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.03 -34.11 75.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.413 -1.429 . . . . 0.0 113.083 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.49 -31.86 73.15 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.715 0.806 . . . . 0.0 112.871 172.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -78.44 -38.13 42.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.958 1.303 . . . . 0.0 111.697 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -58.81 -50.03 75.47 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.533 0.733 . . . . 0.0 112.452 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.0 pt -67.86 -7.18 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.43 1.092 . . . . 0.0 112.98 177.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.51 -7.95 17.28 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.85 1.66 . . . . 0.0 113.607 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.23 159.29 32.7 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 110.702 175.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 51.9 t-20 -64.93 128.87 94.16 Favored Pre-proline 0 N--CA 1.483 1.184 0 O-C-N 121.222 -0.924 . . . . 0.0 112.088 -173.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 31.2 Cg_exo -56.91 -16.58 20.82 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.838 3.026 . . . . 0.0 115.247 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -61.71 -69.71 0.23 Allowed 'General case' 0 C--N 1.348 0.524 0 C-N-CA 125.819 1.648 . . . . 0.0 110.15 167.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.28 -3.12 48.09 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.5 ttt -58.91 -36.65 75.07 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 169.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -65.43 -51.5 51.55 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.422 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 5.8 Cg_endo -51.55 -47.71 24.87 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.048 2.499 . . . . 0.0 114.904 169.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 p -67.36 -37.53 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.788 -1.195 . . . . 0.0 113.162 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.46 -17.34 63.74 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.158 0.983 . . . . 0.0 112.854 175.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.467 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.7 t90 -97.97 -45.24 6.35 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.922 1.237 . . . . 0.0 111.814 168.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 31.5 t-105 -59.33 -34.29 72.16 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.108 0.963 . . . . 0.0 111.456 -172.243 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -74.13 -51.6 15.13 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.453 169.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -71.01 -39.35 72.44 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -168.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -85.93 -40.67 15.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.669 0.668 . . . . 0.0 111.765 172.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 73.71 116.79 0.05 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.827 2.451 . . . . 0.0 114.094 -176.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.88 102.14 7.14 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 169.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.1 t -145.85 39.85 1.15 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.209 1.404 . . . . 0.0 110.35 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.0 t 61.78 153.28 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 127.878 2.471 . . . . 0.0 111.697 -167.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . 0.295 2.1 t80 -101.57 18.03 21.3 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.259 2.318 . . . . 0.0 117.259 -168.397 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.39 37.74 9.32 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.931 1.692 . . . . 0.0 114.749 169.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.48 3.45 77.87 Favored Glycine 0 CA--C 1.546 1.992 0 C-N-CA 125.767 1.651 . . . . 0.0 116.506 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.57 -173.41 49.7 Favored Glycine 0 CA--C 1.539 1.582 0 CA-C-N 119.492 1.646 . . . . 0.0 114.272 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -129.96 -14.77 3.92 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 29.7 p -77.62 36.52 0.21 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -173.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.5 m -60.94 -16.98 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 112.17 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.58 155.38 0.16 Allowed 'General case' 0 C--O 1.236 0.359 0 C-N-CA 127.921 2.488 . . . . 0.0 113.289 169.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.4 tp -77.59 79.11 4.1 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 167.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -67.18 170.16 7.48 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.896 1.278 . . . . 0.0 112.503 -173.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -64.04 -30.86 71.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 120.411 -1.43 . . . . 0.0 112.926 -178.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.8 m -62.06 -47.43 84.73 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.56 -0.713 . . . . 0.0 110.645 168.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.9 -43.71 98.07 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.543 -0.723 . . . . 0.0 110.791 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.52 -27.42 69.14 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.806 -1.184 . . . . 0.0 112.185 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 90.8 m -76.06 -36.79 58.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.569 0.747 . . . . 0.0 111.45 170.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -84.56 -27.6 27.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -176.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.25 -42.17 85.2 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 120.235 1.38 . . . . 0.0 112.918 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.47 -37.46 5.56 Favored 'Trans proline' 0 C--N 1.352 0.756 0 CA-C-N 122.145 1.802 . . . . 0.0 113.02 169.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -67.84 -33.09 74.09 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.226 -1.546 . . . . 0.0 113.76 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.6 m -68.21 -17.27 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.908 0.776 . . . . 0.0 113.083 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -87.43 -52.1 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.72 1.208 . . . . 0.0 110.186 172.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -56.67 -40.33 75.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.423 1.089 . . . . 0.0 111.838 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -71.96 -24.88 61.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.552 -0.717 . . . . 0.0 111.12 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.95 -43.69 21.63 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.318 -0.864 . . . . 0.0 112.193 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -27.78 69.53 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 120.444 1.475 . . . . 0.0 113.586 172.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -71.59 -37.7 70.96 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 169.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -125.22 63.53 42.64 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.001 1.32 . . . . 0.0 111.353 -176.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.17 -13.48 16.07 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.189 3.259 . . . . 0.0 115.905 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -86.1 -21.12 27.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.765 1.626 . . . . 0.0 113.581 -178.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -70.26 160.18 32.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.933 0.893 . . . . 0.0 112.008 -172.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.58 132.05 39.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.118 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -50.03 -36.61 29.53 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.437 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.5 m-85 -80.52 -9.33 59.77 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.795 -1.19 . . . . 0.0 114.06 -176.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -60.68 -26.83 67.39 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.646 -1.284 . . . . 0.0 111.348 168.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -71.88 -2.47 18.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.348 1.459 . . . . 0.0 114.274 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 -31.77 24.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.815 1.189 . . . . 0.0 111.678 168.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.78 -28.11 63.4 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.889 1.276 . . . . 0.0 111.87 -171.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -69.98 -30.19 67.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.75 1.22 . . . . 0.0 114.008 171.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.68 -44.15 6.54 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -167.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.0 m 62.06 -39.42 0.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 127.689 2.396 . . . . 0.0 115.479 -168.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . 0.283 0.9 OUTLIER 67.4 179.7 0.22 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 129.522 3.129 . . . . 0.0 116.305 172.476 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -70.83 -1.78 12.78 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 118.385 2.735 . . . . 0.0 118.385 -165.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.91 147.98 97.92 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 119.841 1.2 . . . . 0.0 112.788 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -63.76 161.17 33.47 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.775 2.317 . . . . 0.0 113.717 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.892 1.677 . . . . 0.0 113.951 -179.011 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.847 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 57.45 50.69 10.86 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.935 1.694 . . . . 0.0 114.26 176.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -65.85 -20.04 66.09 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.829 -1.081 . . . . 0.0 113.088 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 61.1 m 107.51 84.06 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 129.857 3.263 . . . . 0.0 115.761 167.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.29 69.16 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.243 -1.536 . . . . 0.0 111.751 175.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.453 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 8.3 ptpt -77.7 3.03 15.02 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 175.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -125.9 7.97 7.42 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.942 1.297 . . . . 0.0 112.194 169.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 34.5 ttm -62.71 125.04 22.6 Favored 'General case' 0 C--N 1.346 0.457 0 O-C-N 121.048 -1.032 . . . . 0.0 109.597 176.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.4 t -77.63 153.15 33.44 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.81 -0.556 . . . . 0.0 110.1 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.05 -30.62 71.68 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 120.475 -1.391 . . . . 0.0 112.978 -173.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -64.67 -31.67 73.0 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.857 0.753 . . . . 0.0 112.847 170.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -78.53 -38.39 40.65 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.854 1.261 . . . . 0.0 111.414 174.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -59.7 -48.15 82.83 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 121.541 -0.724 . . . . 0.0 112.728 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.57 -2.28 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.961 0.904 . . . . 0.0 113.116 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -109.31 -12.68 14.73 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.282 1.833 . . . . 0.0 114.112 173.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 157.78 35.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.944 1.247 . . . . 0.0 111.032 172.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.403 HD21 ' HD2' ' B' ' 98' ' ' LYS . 51.9 t-20 -66.59 130.21 94.1 Favored Pre-proline 0 N--CA 1.483 1.178 0 O-C-N 121.462 -0.774 . . . . 0.0 111.614 -175.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.82 -18.3 33.75 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.562 2.841 . . . . 0.0 115.188 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 98' ' ' LYS . . . . . 0.403 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.8 mttt -58.5 -68.69 0.23 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.07 1.748 . . . . 0.0 109.512 167.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.31 -2.49 49.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -177.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.9 ttm -61.92 -36.99 82.98 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 120.71 -1.243 . . . . 0.0 111.811 168.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 49.8 m -63.88 -52.26 58.38 Favored Pre-proline 0 N--CA 1.483 1.202 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.827 -177.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' PRO . . . . . 0.405 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 3.1 Cg_exo -47.8 -49.56 13.4 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 124.303 3.335 . . . . 0.0 114.932 169.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.91 -33.9 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 119.201 0.909 . . . . 0.0 113.205 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -25.13 67.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.807 0.843 . . . . 0.0 112.007 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 70.2 t90 -83.55 -55.85 4.06 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.078 165.122 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.4 t90 -62.62 -34.45 77.05 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 117.534 -1.666 . . . . 0.0 114.108 -162.415 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -64.74 -43.29 93.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.15 0.98 . . . . 0.0 111.601 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.49 -31.19 65.18 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.209 1.804 . . . . 0.0 111.739 -177.127 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -146.74 91.74 2.06 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.576 1.95 . . . . 0.0 108.946 -172.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.11 163.39 26.66 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -169.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 12.97 0.31 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 171.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 25.2 p -70.9 30.87 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 126.892 2.077 . . . . 0.0 115.873 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 64.3 t 65.9 120.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 130.054 3.342 . . . . 0.0 113.044 178.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -80.56 142.4 34.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.999 -168.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -130.87 -11.37 3.82 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -168.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.46 -8.0 83.86 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.135 0.874 . . . . 0.0 114.168 171.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 147.47 -133.89 4.92 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.992 1.758 . . . . 0.0 110.692 -173.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -124.55 6.27 8.26 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.008 1.723 . . . . 0.0 113.781 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 8.2 p -80.29 60.7 3.83 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.249 2.22 . . . . 0.0 112.526 -175.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.78 5.6 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.275 1.03 . . . . 0.0 113.742 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -49.36 149.73 2.09 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.171 2.588 . . . . 0.0 113.721 171.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.89 114.08 5.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 168.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -79.42 168.53 19.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.235 1.014 . . . . 0.0 109.69 172.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.69 -25.67 68.31 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.483 -1.386 . . . . 0.0 111.767 173.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 25.1 m -64.38 -44.01 92.7 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 118.501 -0.761 . . . . 0.0 111.122 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -61.14 -50.75 71.93 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.812 1.187 . . . . 0.0 110.107 174.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -57.48 -29.49 64.31 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.615 0.766 . . . . 0.0 112.476 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.9 m -81.21 -36.1 30.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.475 1.11 . . . . 0.0 112.161 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.48 -29.39 28.03 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.88 -41.34 78.48 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 120.163 1.347 . . . . 0.0 113.365 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -74.15 -36.43 3.33 Favored 'Trans proline' 0 C--N 1.354 0.86 0 CA-C-N 122.257 1.842 . . . . 0.0 113.613 169.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -66.81 -30.44 70.63 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.398 -1.439 . . . . 0.0 114.092 -175.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.4 m -69.09 -22.19 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 28.3 mt -79.2 -50.98 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.258 1.023 . . . . 0.0 109.581 170.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -59.05 -38.55 79.64 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.11 -29.98 68.17 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.002 0.819 . . . . 0.0 112.227 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.88 -47.58 44.77 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.168 -0.957 . . . . 0.0 112.505 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -28.27 67.49 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 120.333 1.424 . . . . 0.0 114.472 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -77.29 -24.68 50.93 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.051 1.501 . . . . 0.0 115.051 171.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -135.08 72.79 66.69 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.807 1.243 . . . . 0.0 111.892 172.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.76 -12.16 17.16 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.804 3.003 . . . . 0.0 117.182 -173.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.71 -20.6 39.08 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.6 1.16 . . . . 0.0 113.486 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 52.0 mmtt -65.8 157.55 30.06 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.845 0.858 . . . . 0.0 112.135 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 28.2 t30 -93.07 131.47 38.06 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.2 tp -47.66 -39.02 16.15 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.385 1.474 . . . . 0.0 114.685 -172.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.453 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.4 m-85 -79.72 -8.79 59.45 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 68.4 p -60.46 -26.7 66.97 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 120.596 -1.315 . . . . 0.0 110.976 167.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -73.41 -2.22 21.47 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.18 1.392 . . . . 0.0 113.53 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -81.72 -32.87 31.39 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.688 1.131 . . . . 0.0 111.783 167.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -67.27 -31.12 71.22 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.539 1.136 . . . . 0.0 112.269 -169.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -70.38 -28.05 64.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.592 1.957 . . . . 0.0 115.502 172.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -105.08 98.07 7.83 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.596 1.702 . . . . 0.0 115.596 -166.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 38.2 p -83.37 59.35 4.99 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.893 1.677 . . . . 0.0 111.272 169.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -72.53 96.12 1.9 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 -168.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 15.3 t70 61.79 -40.92 0.14 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 129.617 3.167 . . . . 0.0 118.021 172.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.16 152.61 95.9 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.073 1.349 . . . . 0.0 112.85 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.48 131.91 49.04 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.599 2.866 . . . . 0.0 113.703 179.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.708 1.603 . . . . 0.0 111.648 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.277 14.3 t-20 68.08 69.91 0.33 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.965 1.84 . . . . 0.0 112.668 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -119.09 154.22 33.55 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 130.075 3.35 . . . . 0.0 102.929 166.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.6 m -94.77 89.58 5.75 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 124.562 1.145 . . . . 0.0 112.345 -163.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.17 65.34 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 120.008 1.277 . . . . 0.0 111.014 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.2 mtmt -62.96 -20.72 65.52 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 127.16 2.184 . . . . 0.0 115.018 175.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -121.67 16.2 11.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.774 1.63 . . . . 0.0 111.778 177.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.3 ttm -61.77 117.73 6.23 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.53 155.04 36.48 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.162 -0.961 . . . . 0.0 109.499 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.18 -32.81 74.3 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.303 -1.498 . . . . 0.0 112.787 -172.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -62.84 -35.2 79.16 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 170.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -75.41 -37.88 60.21 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.826 1.251 . . . . 0.0 111.479 174.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -60.18 -50.69 72.67 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.531 -0.731 . . . . 0.0 112.241 177.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.5 pt -69.52 -1.19 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.547 1.139 . . . . 0.0 112.958 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -110.85 -10.87 14.41 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.728 1.611 . . . . 0.0 113.972 173.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 164.92 22.4 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.962 -1.086 . . . . 0.0 110.255 169.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.77 128.04 93.19 Favored Pre-proline 0 CA--C 1.556 1.196 0 O-C-N 120.84 -1.162 . . . . 0.0 112.219 -176.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -61.3 -7.26 8.06 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.788 3.658 . . . . 0.0 116.24 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 5.9 mptt -71.56 -59.29 2.83 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 127.072 2.149 . . . . 0.0 109.056 165.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.13 0.22 54.09 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 82.1 mtp -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 120.84 -1.162 . . . . 0.0 112.364 169.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.7 m -65.63 -51.18 51.82 Favored Pre-proline 0 N--CA 1.483 1.189 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.05 -45.62 39.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.179 2.586 . . . . 0.0 114.932 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.7 p -71.64 -31.88 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.605 -1.31 . . . . 0.0 113.419 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.1 -24.16 67.59 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.742 0.817 . . . . 0.0 111.485 171.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.439 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 74.0 t90 -85.09 -53.43 5.28 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.263 167.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.424 ' CH2' ' HB3' ' B' ' 105' ' ' TRP . 0.1 OUTLIER -52.94 -34.48 55.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.075 0.94 . . . . 0.0 112.62 -172.679 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -69.62 -49.14 56.69 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.676 1.19 . . . . 0.0 112.259 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.95 -38.15 85.59 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.79 1.636 . . . . 0.0 111.813 -176.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -123.78 94.22 4.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.826 1.651 . . . . 0.0 110.409 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.68 152.66 38.46 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.813 0.845 . . . . 0.0 112.637 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -74.98 23.68 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.066 1.346 . . . . 0.0 114.29 -171.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 61.6 p -75.8 27.8 0.11 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.024 2.13 . . . . 0.0 113.596 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 71.9 t 61.8 147.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 129.408 3.083 . . . . 0.0 114.387 -175.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.26 139.09 40.98 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.846 -1.159 . . . . 0.0 112.412 -177.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -152.95 153.26 32.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.423 1.489 . . . . 0.0 112.275 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.12 13.53 64.69 Favored Glycine 0 CA--C 1.542 1.726 0 C-N-CA 124.121 0.867 . . . . 0.0 114.449 -175.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.41 178.23 32.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.869 2.176 . . . . 0.0 111.397 -170.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -134.04 4.82 3.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 m -83.0 69.95 9.91 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.596 -1.315 . . . . 0.0 111.658 -170.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.2 t -58.58 -29.51 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 125.708 1.603 . . . . 0.0 112.507 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.51 154.71 3.37 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.228 1.811 . . . . 0.0 113.164 169.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -66.19 126.19 27.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.527 -0.733 . . . . 0.0 110.435 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -89.57 167.19 13.15 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.484 1.914 . . . . 0.0 108.95 170.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.42 -28.97 69.03 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 119.874 -1.766 . . . . 0.0 113.255 -170.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.1 m -65.7 -41.96 91.73 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.443 -0.785 . . . . 0.0 110.849 168.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -63.94 -41.75 97.52 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.126 -0.984 . . . . 0.0 109.827 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.29 -24.99 67.85 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.08 0.952 . . . . 0.0 112.211 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.8 m -79.83 -32.19 40.6 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.46 1.104 . . . . 0.0 111.627 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -87.4 -28.7 21.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.577 1.08 . . . . 0.0 113.579 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.39 -41.97 79.27 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.185 173.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.41 -36.51 6.78 Favored 'Trans proline' 0 C--N 1.355 0.91 0 CA-C-N 122.382 1.886 . . . . 0.0 113.357 169.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -65.96 -35.62 81.08 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 120.317 -1.489 . . . . 0.0 113.565 -177.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.23 -21.43 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 174.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.6 mt -82.72 -51.37 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.901 0.88 . . . . 0.0 110.555 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.97 -43.21 73.3 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.043 0.937 . . . . 0.0 111.33 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -67.46 -30.05 69.67 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.918 -0.489 . . . . 0.0 111.732 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.5 m -74.41 -46.03 42.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.182 -0.913 . . . . 0.0 113.174 173.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -30.34 68.49 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.866 1.667 . . . . 0.0 114.453 177.169 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.252 20.4 pttt -79.21 -24.73 42.91 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 175.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -135.29 74.95 60.22 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 125.323 1.449 . . . . 0.0 112.522 169.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -59.53 -11.3 13.57 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.523 3.482 . . . . 0.0 117.176 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -80.15 -21.99 42.52 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.063 1.345 . . . . 0.0 113.369 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -69.43 159.22 33.63 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.861 1.264 . . . . 0.0 111.64 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.38 148.16 30.73 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.625 -0.672 . . . . 0.0 109.991 170.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.35 -33.55 75.76 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.27 -0.894 . . . . 0.0 112.666 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.422 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.7 m-85 -89.96 -24.66 21.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 117.007 2.225 . . . . 0.0 117.007 -169.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.8 t -60.0 -21.99 61.99 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.057 -1.027 . . . . 0.0 111.902 171.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -60.52 -7.44 2.14 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.944 -1.723 . . . . 0.0 113.709 171.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.7 tptt -66.9 -37.51 84.51 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.522 1.529 . . . . 0.0 112.258 167.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -29.88 71.03 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -167.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -85.29 -23.16 28.26 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.581 1.952 . . . . 0.0 115.848 -175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -121.74 12.18 10.58 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 118.501 2.778 . . . . 0.0 118.501 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.6 m -54.16 104.34 0.1 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 120.245 1.384 . . . . 0.0 113.921 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -101.98 -94.61 0.29 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.771 1.628 . . . . 0.0 114.837 -172.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.66 -26.37 62.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 116.339 1.977 . . . . 0.0 116.339 -166.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.57 153.1 81.02 Favored Pre-proline 0 CA--C 1.548 0.871 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -83.06 167.59 14.06 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.756 2.97 . . . . 0.0 111.023 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.165 1.386 . . . . 0.0 112.022 177.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.009 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 52.9 t30 54.68 63.97 1.97 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.799 1.64 . . . . 0.0 112.98 -175.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.454 ' HB3' ' HE3' ' A' ' 19' ' ' LYS 0.25 52.9 mm-40 -66.53 -6.53 15.32 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.873 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 72.7 m 108.0 84.47 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 130.595 3.558 . . . . 0.0 112.334 171.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.84 67.94 Favored 'General case' 0 CA--C 1.556 1.205 0 O-C-N 120.843 -1.161 . . . . 0.0 111.219 173.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.461 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 11.9 mtmt -63.42 -16.72 61.38 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 127.232 2.213 . . . . 0.0 116.601 173.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -121.2 9.32 10.43 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.866 1.266 . . . . 0.0 112.603 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.4 ttm -60.93 124.1 19.5 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.391 -0.818 . . . . 0.0 109.42 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -77.46 156.04 31.34 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.634 -0.667 . . . . 0.0 110.907 -177.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.41 -32.83 74.61 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.133 -1.604 . . . . 0.0 113.112 -173.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.78 -29.03 69.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.032 0.833 . . . . 0.0 112.611 171.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -84.25 -36.33 22.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.756 1.622 . . . . 0.0 111.313 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -62.26 -48.95 77.66 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.381 -0.824 . . . . 0.0 112.789 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.69 -6.3 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.816 0.847 . . . . 0.0 112.874 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.91 -11.57 15.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.314 1.846 . . . . 0.0 114.535 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.88 158.4 35.61 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.906 1.23 . . . . 0.0 110.845 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 96' ' ' ASN . . . . . 0.445 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 50.3 t-20 -66.38 131.03 94.22 Favored Pre-proline 0 N--CA 1.481 1.085 0 O-C-N 121.335 -0.853 . . . . 0.0 111.622 -176.212 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 97' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 35.4 Cg_exo -60.9 -18.68 58.46 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.125 2.55 . . . . 0.0 114.566 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -55.34 -67.82 0.25 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.183 1.393 . . . . 0.0 109.85 168.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.02 -4.58 57.07 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 31.4 ttm -59.88 -41.04 90.69 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.04 -1.038 . . . . 0.0 112.032 168.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 67.5 m -56.04 -54.9 47.32 Favored Pre-proline 0 N--CA 1.484 1.229 0 CA-C-O 117.97 -1.014 . . . . 0.0 113.45 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.74 -53.82 5.04 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.02 3.147 . . . . 0.0 113.699 171.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.6 -31.91 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 119.448 -2.032 . . . . 0.0 113.306 -176.054 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.96 73.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.186 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 105' ' ' TRP . . . . . 0.424 ' HB3' ' CH2' ' A' ' 27' ' ' TRP 0.288 0.0 OUTLIER -86.37 -39.23 16.63 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 116.487 -1.72 . . . . 0.0 112.322 176.261 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' B' B ' 106' ' ' TRP . . . . . 0.439 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.4 m0 -62.26 -22.13 65.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 122.419 2.372 . . . . 0.0 113.022 173.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -77.47 -57.84 3.6 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.981 0.912 . . . . 0.0 111.873 168.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.32 -33.62 76.39 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.671 0.788 . . . . 0.0 112.271 -172.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -112.0 60.48 0.62 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.186 1.794 . . . . 0.0 111.274 170.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -49.24 154.67 0.8 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.005 1.322 . . . . 0.0 112.323 169.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 67.35 -25.96 0.12 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 127.309 2.243 . . . . 0.0 114.635 -169.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 8.4 p 62.54 -34.37 0.11 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 129.202 3.001 . . . . 0.0 117.0 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 85.5 t -71.21 122.23 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 125.919 1.688 . . . . 0.0 109.889 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.47 156.64 18.99 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -168.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -149.5 146.23 27.28 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.32 1.448 . . . . 0.0 111.799 -172.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.4 9.04 57.25 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 115.712 1.045 . . . . 0.0 115.712 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 169.23 -161.26 34.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.65 1.595 . . . . 0.0 112.42 -174.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -135.28 11.03 3.53 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 2.5 p -78.35 46.6 0.63 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.472 1.909 . . . . 0.0 114.557 -171.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 33.7 m -64.79 -23.61 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 124.769 1.228 . . . . 0.0 112.762 169.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.69 141.27 21.4 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.229 1.012 . . . . 0.0 110.739 169.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 19.7 mt -47.66 108.69 0.17 Allowed 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 118.843 0.747 . . . . 0.0 111.398 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -79.67 164.89 23.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.142 1.377 . . . . 0.0 109.772 176.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -64.96 -28.66 69.67 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.078 -1.639 . . . . 0.0 112.467 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.6 m -62.82 -42.38 99.7 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.482 -0.762 . . . . 0.0 110.801 168.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.49 -45.67 71.72 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.387 -0.82 . . . . 0.0 110.572 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 91.6 mt -57.14 -28.21 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.028 0.931 . . . . 0.0 112.389 173.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.5 m -80.8 -36.11 32.17 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.921 0.888 . . . . 0.0 112.013 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -81.95 -31.4 31.26 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.758 1.163 . . . . 0.0 114.058 -177.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.02 -39.68 72.62 Favored Pre-proline 0 CA--C 1.552 1.039 0 CA-C-N 120.07 1.305 . . . . 0.0 113.163 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -75.15 -36.37 2.51 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 122.388 1.889 . . . . 0.0 113.366 169.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -66.06 -29.74 70.14 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.395 -1.441 . . . . 0.0 113.908 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 32.3 m -69.38 -21.75 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 122.968 0.507 . . . . 0.0 112.327 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 10.3 mt -77.68 -50.7 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.327 1.051 . . . . 0.0 109.697 169.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.42 -39.57 87.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.293 0.637 . . . . 0.0 112.516 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.46 -27.46 65.24 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.019 0.827 . . . . 0.0 112.209 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.11 -50.11 20.93 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.453 -0.779 . . . . 0.0 112.319 175.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -27.32 68.4 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -79.05 -20.18 49.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 171.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -136.44 66.71 58.93 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.472 1.509 . . . . 0.0 110.52 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.23 -14.26 37.17 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 124.142 3.228 . . . . 0.0 116.494 -168.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.95 -24.72 48.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -62.62 157.96 19.42 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.937 1.295 . . . . 0.0 112.302 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -82.17 150.65 27.29 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.552 -0.717 . . . . 0.0 109.988 171.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.72 -41.18 99.04 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.293 -0.879 . . . . 0.0 113.15 176.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 146' ' ' TYR . . . . . 0.461 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.7 m-85 -82.41 -19.72 38.5 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -169.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 11.6 t -64.04 -15.01 58.5 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.793 -1.192 . . . . 0.0 112.197 169.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -67.87 -2.56 7.56 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 119.313 -2.117 . . . . 0.0 113.532 169.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -77.71 -30.81 51.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.69 1.132 . . . . 0.0 111.92 165.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -63.52 -33.38 75.45 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.919 1.288 . . . . 0.0 112.177 -169.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.94 -29.06 64.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.618 1.967 . . . . 0.0 115.346 170.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -98.77 105.26 17.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.408 1.483 . . . . 0.0 113.025 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.6 p -91.87 -6.08 52.17 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -84.2 16.95 2.7 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -72.87 1.81 7.97 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -146.38 149.91 39.21 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 128.051 2.54 . . . . 0.0 109.158 169.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.17 156.48 64.76 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.505 2.803 . . . . 0.0 112.664 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.189 0 C-N-CA 125.66 1.584 . . . . 0.0 110.995 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 . . . . . 0 CA--C 1.542 0.638 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.973 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.2 t 97.07 93.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 128.885 2.874 . . . . 0.0 117.422 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.53 -33.64 70.09 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 119.921 -1.737 . . . . 0.0 112.345 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 1.1 ptpt -73.85 -9.87 59.08 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 176.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -113.9 5.06 16.07 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.92 1.288 . . . . 0.0 112.468 168.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 29.0 ttm -60.57 127.31 31.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.957 1.253 . . . . 0.0 109.482 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -78.99 155.89 28.68 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.33 -35.75 78.26 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 120.338 -1.476 . . . . 0.0 112.801 -175.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -61.69 -32.47 72.67 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.668 0.787 . . . . 0.0 113.014 172.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -80.57 -36.84 32.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.115 1.366 . . . . 0.0 111.56 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.11 -48.57 81.13 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.532 -0.73 . . . . 0.0 112.327 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.2 pt -70.41 -2.04 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 124.318 1.047 . . . . 0.0 112.809 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -113.46 -15.08 12.66 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.973 1.709 . . . . 0.0 114.281 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 161.81 20.5 Favored 'General case' 0 CA--C 1.558 1.251 0 O-C-N 120.981 -1.074 . . . . 0.0 110.498 169.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.447 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 43.3 t-20 -63.92 132.53 95.28 Favored Pre-proline 0 N--CA 1.483 1.189 0 O-C-N 120.894 -1.129 . . . . 0.0 112.011 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 25.2 Cg_exo -62.22 -16.94 54.15 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.332 2.688 . . . . 0.0 114.831 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mptt -57.87 -62.81 1.54 Allowed 'General case' 0 C--N 1.351 0.657 0 C-N-CA 125.218 1.407 . . . . 0.0 108.829 167.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -77.56 -10.48 59.52 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 89.0 mtp -60.21 -37.68 81.02 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 120.905 -1.122 . . . . 0.0 112.937 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.4 m -61.22 -52.09 73.68 Favored Pre-proline 0 N--CA 1.485 1.295 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.444 ' HB3' ' CG ' ' B' ' 106' ' ' TRP . 38.2 Cg_endo -59.7 -41.79 52.34 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.772 2.315 . . . . 0.0 113.285 169.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 20' ' ' ALA . 87.9 t -56.73 -42.18 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 120.904 -1.123 . . . . 0.0 111.725 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.17 82.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.821 0.848 . . . . 0.0 111.556 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.436 ' HB3' ' CH2' ' B' ' 106' ' ' TRP . 0.0 OUTLIER -76.14 -36.69 58.68 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.882 1.219 . . . . 0.0 111.351 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.495 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -52.13 -41.95 62.95 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.976 1.262 . . . . 0.0 112.254 176.111 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -72.98 -53.31 11.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.795 1.638 . . . . 0.0 111.805 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 123.49 0.716 . . . . 0.0 112.237 -169.788 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 N--CA 1.464 0.246 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.23 -34.6 72.4 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.563 1.145 . . . . 0.0 111.904 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 98.4 m -71.98 -36.2 69.74 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.762 0.825 . . . . 0.0 111.189 174.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -79.49 -24.86 42.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.519 -178.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.77 -46.1 98.53 Favored Pre-proline 0 N--CA 1.481 1.092 0 CA-C-N 120.824 1.647 . . . . 0.0 112.535 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.25 -37.6 10.16 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.808 1.672 . . . . 0.0 113.3 170.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -66.08 -34.9 79.12 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.704 -1.247 . . . . 0.0 113.391 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.6 m -68.96 -17.17 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 118.965 0.802 . . . . 0.0 113.16 175.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -88.42 -52.44 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.369 1.068 . . . . 0.0 110.367 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -55.7 -47.82 76.17 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.292 1.037 . . . . 0.0 110.621 177.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -63.54 -25.24 68.16 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.43 -0.794 . . . . 0.0 112.106 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.17 -49.03 13.21 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.484 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.01 68.62 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 120.961 1.71 . . . . 0.0 113.966 174.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -71.22 -28.32 64.11 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 114.392 169.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.4 m-80 -135.37 66.57 65.89 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.982 1.313 . . . . 0.0 112.383 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -57.59 -15.68 21.28 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.591 2.861 . . . . 0.0 116.575 -173.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -82.6 -21.3 35.22 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.298 1.439 . . . . 0.0 113.523 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -71.62 160.37 32.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.694 1.197 . . . . 0.0 111.933 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -76.56 154.7 34.26 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.854 -0.529 . . . . 0.0 109.891 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -70.18 -38.42 75.37 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.264 -0.898 . . . . 0.0 113.103 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 1.4 m-85 -82.58 -21.96 35.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.0 t -60.11 -20.76 59.86 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.377 -0.827 . . . . 0.0 111.961 173.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -62.03 -5.07 1.93 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.586 -1.946 . . . . 0.0 114.074 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -33.77 74.13 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 119.806 1.184 . . . . 0.0 111.518 165.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -62.13 -31.93 72.46 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -167.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -74.78 -28.01 60.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.774 1.63 . . . . 0.0 115.129 176.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -166.281 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 . . . . . 0 N--CA 1.446 -0.647 0 N-CA-C 103.69 -2.707 . . . . 0.0 103.69 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m -87.57 87.91 7.52 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 125.298 1.439 . . . . 0.0 113.285 -165.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.88 -38.57 56.59 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 120.383 1.447 . . . . 0.0 110.463 170.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -67.8 -7.03 24.28 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 127.686 2.394 . . . . 0.0 115.707 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -136.59 18.85 3.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.91 1.284 . . . . 0.0 112.482 174.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.9 ttm -59.48 120.92 10.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 168.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.0 t -73.77 153.79 39.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.107 -0.995 . . . . 0.0 109.552 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.71 -31.24 72.11 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.55 -1.344 . . . . 0.0 113.235 -172.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -65.84 -32.43 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.198 0.908 . . . . 0.0 113.121 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -76.5 -36.6 57.69 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.292 1.437 . . . . 0.0 111.115 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -63.79 -48.64 76.07 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.29 -0.881 . . . . 0.0 112.932 177.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.0 pt -69.63 -5.16 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 123.345 0.658 . . . . 0.0 112.697 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -103.47 -15.46 15.87 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.221 1.808 . . . . 0.0 114.23 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 158.86 31.72 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.9 1.227 . . . . 0.0 110.581 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.408 HD21 ' HD2' ' B' ' 98' ' ' LYS . 49.7 t-20 -66.4 132.05 94.29 Favored Pre-proline 0 N--CA 1.481 1.092 0 O-C-N 121.416 -0.802 . . . . 0.0 111.6 -174.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -56.95 -20.46 36.69 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.81 3.007 . . . . 0.0 115.379 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 96' ' ' ASN . 32.1 mttt -56.7 -64.12 0.98 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.996 1.719 . . . . 0.0 108.89 166.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.34 -12.15 59.1 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.0 ttm -57.02 -35.87 69.77 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.511 -1.368 . . . . 0.0 111.916 172.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.4 m -63.0 -54.92 42.25 Favored Pre-proline 0 N--CA 1.482 1.155 0 C-N-CA 124.319 1.047 . . . . 0.0 112.81 -177.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . 0.419 ' HG2' HG22 ' A' ' 24' ' ' VAL . 1.5 Cg_endo -50.1 -45.94 30.74 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.5 2.8 . . . . 0.0 113.685 168.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.64 -38.51 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.003 0.82 . . . . 0.0 111.838 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.63 90.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.576 0.751 . . . . 0.0 111.297 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CG ' ' CH2' ' A' ' 27' ' ' TRP . 89.5 t90 -67.35 -46.79 72.35 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.59 1.086 . . . . 0.0 110.243 167.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.444 ' CG ' ' HB3' ' A' ' 23' ' ' PRO . 0.6 OUTLIER -58.34 -33.28 69.36 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 123.427 1.584 . . . . 0.0 113.073 -168.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.3 tmm? -76.05 -42.59 47.11 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.234 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . 0.415 HD21 HG11 ' B' ' 133' ' ' VAL . 3.4 mm? . . . . . 0 CA--C 1.55 0.954 0 O-C-N 120.849 -1.157 . . . . 0.0 114.063 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.57 -30.06 64.94 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.183 -0.948 . . . . 0.0 112.706 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 68.0 m -80.39 -34.47 36.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.952 0.901 . . . . 0.0 111.949 174.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -79.63 -36.84 37.28 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 117.869 -1.062 . . . . 0.0 113.527 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -48.96 -46.3 74.68 Favored Pre-proline 0 N--CA 1.478 0.929 0 CA-C-N 120.238 1.381 . . . . 0.0 113.017 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.6 -38.21 6.24 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 CA-C-N 122.074 1.777 . . . . 0.0 113.448 171.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -64.81 -34.4 78.27 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.913 1.233 . . . . 0.0 113.367 -175.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . 0.415 HG11 HD21 ' B' ' 108' ' ' LEU . 20.8 m -75.48 -27.86 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.217 0.607 . . . . 0.0 112.575 177.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.9 mt -67.8 -47.24 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.09 -38.82 80.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.887 0.875 . . . . 0.0 112.316 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.49 -31.88 73.19 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.181 0.901 . . . . 0.0 112.149 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -72.14 -48.01 46.77 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.802 -1.186 . . . . 0.0 112.397 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -29.4 68.54 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.181 1.355 . . . . 0.0 114.502 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -79.32 -22.08 45.04 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 171.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.47 64.89 66.12 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 126.66 1.984 . . . . 0.0 110.45 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -64.22 -11.49 28.11 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.988 3.125 . . . . 0.0 115.881 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -81.42 -21.26 39.02 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.705 1.202 . . . . 0.0 113.387 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -68.03 159.03 31.6 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.838 0.855 . . . . 0.0 112.373 -173.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -83.9 127.91 34.18 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.7 tp -44.73 -38.86 4.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.03 -7.59 58.23 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 57.4 p -60.43 -30.15 69.45 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 120.579 -1.325 . . . . 0.0 111.125 167.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -69.54 -2.45 11.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.774 1.63 . . . . 0.0 113.533 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -38.38 53.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.159 0.983 . . . . 0.0 110.896 166.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -29.97 71.02 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -167.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -68.68 -27.78 66.28 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.661 1.984 . . . . 0.0 115.646 170.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.745 0 C-N-CA 125.11 1.364 . . . . 0.0 114.214 -167.537 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 . . . . . 0 N--CA 1.444 -0.744 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.0 t -102.75 92.93 4.82 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.895 1.278 . . . . 0.0 113.065 -165.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.58 68.45 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.418 -1.426 . . . . 0.0 111.329 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 5.6 ptpt -74.41 -7.22 52.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.241 1.816 . . . . 0.0 115.228 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -123.41 15.81 9.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.404 1.482 . . . . 0.0 111.95 168.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.1 ttm -61.86 118.63 7.46 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.829 -1.169 . . . . 0.0 108.446 171.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -76.64 155.35 33.51 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.059 -1.026 . . . . 0.0 109.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.84 -29.72 69.71 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 120.312 -1.492 . . . . 0.0 113.784 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -40.74 96.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.114 0.87 . . . . 0.0 111.804 169.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -66.86 -37.02 83.65 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.772 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -60.91 -52.99 62.68 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.39 -0.819 . . . . 0.0 112.299 177.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.04 -0.93 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.103 1.361 . . . . 0.0 112.785 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -107.16 -15.59 14.63 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.427 1.491 . . . . 0.0 113.61 172.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.38 164.56 22.67 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.076 -1.015 . . . . 0.0 110.522 169.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.487 HD21 ' HD3' ' A' ' 19' ' ' LYS . 52.7 t-20 -71.73 131.37 86.05 Favored Pre-proline 0 N--CA 1.484 1.233 0 O-C-N 120.867 -1.145 . . . . 0.0 112.411 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -18.37 23.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.557 3.505 . . . . 0.0 116.299 175.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.487 ' HD3' HD21 ' A' ' 17' ' ' ASN . 10.9 mttt -60.36 -58.19 9.55 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.304 1.842 . . . . 0.0 109.212 167.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.46 -2.68 58.78 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 75.4 mtp -63.18 -36.65 84.33 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.43 -1.419 . . . . 0.0 111.509 169.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.7 m -59.81 -52.25 75.08 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 124.776 1.231 . . . . 0.0 113.362 -177.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -53.19 -58.58 1.38 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.165 2.576 . . . . 0.0 113.94 167.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.4 p -63.48 -25.26 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 120.893 1.679 . . . . 0.0 113.294 -169.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.37 67.94 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 118.124 -0.941 . . . . 0.0 113.21 171.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 62.6 t90 -84.03 -55.34 4.27 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.176 1.353 . . . . 0.0 114.303 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.451 ' CD1' ' HB3' ' B' ' 102' ' ' PRO . 4.7 m95 -51.68 -40.28 59.79 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.886 0.85 . . . . 0.0 110.888 -173.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -58.57 -49.38 77.65 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.941 1.697 . . . . 0.0 111.934 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 C-N-CA 124.976 1.311 . . . . 0.0 113.755 175.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.468 0.45 0 CA-C-O 119.555 -0.259 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.47 -28.38 69.17 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.179 -0.951 . . . . 0.0 112.127 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 96.8 m -74.47 -38.41 62.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.39 0.676 . . . . 0.0 111.06 172.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -83.17 -32.21 26.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.121 -1.419 . . . . 0.0 114.033 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -46.64 -48.62 48.64 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-N 120.626 1.557 . . . . 0.0 112.77 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -36.3 30.01 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.376 2.051 . . . . 0.0 113.949 172.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -64.11 -34.19 77.47 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.833 -1.167 . . . . 0.0 112.977 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.09 -30.4 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.61 0.641 . . . . 0.0 111.692 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 mt -78.62 -51.17 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.506 0.722 . . . . 0.0 110.585 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.49 -39.3 87.2 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.646 0.778 . . . . 0.0 112.075 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -68.73 -31.05 69.84 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.305 0.642 . . . . 0.0 111.293 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.4 m -73.43 -46.04 50.86 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.086 -1.009 . . . . 0.0 113.223 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.42 68.77 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 121.032 1.742 . . . . 0.0 114.235 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -76.88 -33.79 57.81 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 174.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -132.4 77.56 69.96 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.631 1.172 . . . . 0.0 112.019 172.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -54.13 -11.78 3.07 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 124.972 3.781 . . . . 0.0 117.255 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -27.23 56.75 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.22 1.408 . . . . 0.0 112.527 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt -65.97 157.51 30.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.798 1.239 . . . . 0.0 112.493 -174.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -93.05 133.89 35.74 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 169.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.6 tp -49.81 -32.87 15.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.448 1.499 . . . . 0.0 114.175 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.1 m-85 -82.8 -10.76 58.72 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.2 p -60.61 -25.79 66.53 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.698 -1.252 . . . . 0.0 111.573 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -72.73 -0.08 12.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.723 1.609 . . . . 0.0 113.944 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.36 -34.18 25.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.649 1.579 . . . . 0.0 111.48 167.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -70.18 -28.8 65.6 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.045 1.338 . . . . 0.0 111.933 -170.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -71.88 -30.28 65.24 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.49 1.516 . . . . 0.0 115.008 175.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.568 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -166.294 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 97.63 99.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.891 2.876 . . . . 0.0 116.156 168.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.33 -30.9 67.06 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 120.083 -1.636 . . . . 0.0 111.774 169.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -67.08 -17.85 65.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.085 1.754 . . . . 0.0 115.292 174.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.57 6.29 14.57 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.596 1.158 . . . . 0.0 113.175 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.3 ttm -63.21 125.71 24.99 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.96 -1.087 . . . . 0.0 110.651 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -79.87 155.48 27.78 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.834 -1.166 . . . . 0.0 110.866 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.08 -35.36 78.43 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.116 -1.615 . . . . 0.0 112.862 -174.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.31 -29.42 70.5 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.182 0.901 . . . . 0.0 112.731 173.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -82.45 -35.58 27.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.719 1.608 . . . . 0.0 111.386 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -63.35 -48.55 77.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.789 0.835 . . . . 0.0 112.727 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -67.75 -4.52 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.785 0.834 . . . . 0.0 112.854 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.28 -11.03 15.66 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.487 1.915 . . . . 0.0 114.404 172.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 158.26 36.01 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.653 -1.279 . . . . 0.0 110.83 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -65.41 129.98 94.55 Favored Pre-proline 0 N--CA 1.478 0.941 0 O-C-N 121.207 -0.933 . . . . 0.0 111.534 -178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.75 -18.08 53.78 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.935 2.423 . . . . 0.0 114.808 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -54.5 -66.95 0.31 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.217 1.407 . . . . 0.0 109.521 168.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.55 -9.84 59.69 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.8 ttm -56.26 -43.44 78.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.871 0.868 . . . . 0.0 112.581 171.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 86.6 m -55.85 -54.73 48.75 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.019 -0.991 . . . . 0.0 113.655 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 7.4 Cg_endo -54.4 -54.2 5.01 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 124.438 3.425 . . . . 0.0 114.073 169.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.13 -31.39 52.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 119.667 -1.896 . . . . 0.0 113.338 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.27 71.16 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.399 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.407 ' HB3' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -86.83 -41.1 14.32 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 116.402 -1.761 . . . . 0.0 111.593 175.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.421 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 6.2 m0 -59.74 -22.95 62.77 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 123.356 2.798 . . . . 0.0 113.659 171.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.9 tmm? -76.97 -63.99 1.23 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.43 0.692 . . . . 0.0 111.092 167.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 C-N-CA 124.639 1.176 . . . . 0.0 113.842 -168.733 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 N--CA 1.47 0.544 0 CA-C-O 120.033 -0.032 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 92.0 mt -57.28 -28.35 62.92 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.523 0.729 . . . . 0.0 112.48 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 53.3 m -83.94 -34.69 24.41 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.607 1.163 . . . . 0.0 112.406 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -84.67 -33.34 23.23 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 117.608 -1.187 . . . . 0.0 113.751 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.33 -43.86 92.15 Favored Pre-proline 0 N--CA 1.481 1.11 0 CA-C-N 120.457 1.48 . . . . 0.0 112.871 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.46 -39.07 7.55 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 CA-C-N 122.389 1.889 . . . . 0.0 113.312 171.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.24 -33.91 77.1 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.776 1.171 . . . . 0.0 113.76 -174.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.32 -24.07 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.358 0.663 . . . . 0.0 112.355 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 27.5 mt -73.95 -49.78 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.607 0.763 . . . . 0.0 109.567 170.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -58.51 -41.56 85.7 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.957 0.903 . . . . 0.0 112.258 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.79 -26.16 65.96 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.167 -0.958 . . . . 0.0 112.302 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.2 -47.15 25.09 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.766 0.827 . . . . 0.0 112.215 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -26.86 68.14 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 120.268 1.394 . . . . 0.0 114.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.258 15.1 ptpt -84.13 -10.15 58.01 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -137.56 61.35 30.42 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 111.112 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.65 -14.16 34.19 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.877 3.051 . . . . 0.0 115.679 -168.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -85.57 -14.99 44.07 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 113.657 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -74.43 158.5 33.76 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.199 0.999 . . . . 0.0 111.765 -172.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -92.86 133.7 35.81 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.23 -40.05 46.42 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.914 1.285 . . . . 0.0 114.272 -169.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.257 5.0 m-85 -79.2 -6.84 57.53 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.9 p -61.97 -27.12 68.63 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.694 -1.254 . . . . 0.0 111.176 168.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -72.58 -3.66 26.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.04 1.336 . . . . 0.0 113.943 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -81.38 -29.46 34.01 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.374 0.988 . . . . 0.0 112.036 167.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -68.97 -32.12 71.47 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.747 0.819 . . . . 0.0 112.049 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -69.67 -28.43 65.86 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.16 1.784 . . . . 0.0 115.376 169.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -165.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.517 ' H ' ' HG2' ' B' ' 98' ' ' LYS . 15.0 m -134.48 56.76 1.83 Allowed 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 123.675 0.79 . . . . 0.0 110.248 169.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -52.76 -40.97 63.6 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 121.273 1.851 . . . . 0.0 111.475 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 3.3 ptpt -64.53 -11.04 30.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.511 2.324 . . . . 0.0 116.172 175.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -133.28 21.0 4.02 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.036 1.735 . . . . 0.0 111.727 171.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.477 ' HE1' ' HB2' ' B' ' 99' ' ' ALA . 19.3 ttm -62.13 122.65 16.08 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.6 t -76.96 153.97 34.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.08 -32.61 74.03 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 120.616 -1.302 . . . . 0.0 112.823 -173.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -62.96 -31.13 72.17 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.712 0.805 . . . . 0.0 112.971 170.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.73 -39.41 27.04 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.41 1.484 . . . . 0.0 111.851 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -58.71 -49.76 76.42 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.476 -0.765 . . . . 0.0 113.028 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -67.25 -4.44 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 C-N-CA 123.979 0.912 . . . . 0.0 112.668 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -112.94 -5.48 13.81 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.227 1.811 . . . . 0.0 113.813 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.424 HD22 ' HE1' ' A' ' 8' ' ' MET . 0.3 OUTLIER -75.81 161.98 28.55 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.897 -1.127 . . . . 0.0 110.382 173.618 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.439 HD21 ' HD3' ' A' ' 19' ' ' LYS . 45.2 t-20 -66.41 128.19 93.71 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 120.899 -1.126 . . . . 0.0 111.611 -174.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.4 -20.81 16.32 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.339 3.359 . . . . 0.0 115.879 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HD3' HD21 ' A' ' 17' ' ' ASN . 5.4 mptt -59.86 -67.07 0.42 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.181 1.792 . . . . 0.0 109.811 168.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.16 -5.29 57.53 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -177.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -60.79 -40.38 92.44 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.1 -1.0 . . . . 0.0 112.674 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.253 23.7 m -65.4 -52.11 47.79 Favored Pre-proline 0 N--CA 1.479 0.993 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -177.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.69 -42.85 42.19 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.558 2.839 . . . . 0.0 116.146 169.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.33 -37.44 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 119.913 1.233 . . . . 0.0 113.087 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.83 -28.62 68.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.781 0.832 . . . . 0.0 111.738 171.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.8 t90 -81.83 -53.77 5.91 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 117.693 -1.146 . . . . 0.0 112.406 170.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.43 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.0 t90 -64.12 -37.81 88.78 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 120.365 1.439 . . . . 0.0 111.281 -167.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -59.08 -31.23 68.71 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.746 1.218 . . . . 0.0 112.615 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 N--CA 1.467 0.377 0 CA-C-O 119.722 -0.18 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 71.6 mt -64.63 -28.58 69.72 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.118 -0.989 . . . . 0.0 112.369 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 93.6 m -71.8 -41.68 67.98 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.534 0.734 . . . . 0.0 110.841 169.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -75.95 -33.32 59.8 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -175.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.253 1.6 mp -54.21 -41.94 91.27 Favored Pre-proline 0 CA--C 1.554 1.116 0 CA-C-N 119.694 1.134 . . . . 0.0 112.654 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.95 -36.81 5.57 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.193 1.929 . . . . 0.0 113.823 169.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -64.17 -33.43 75.77 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.16 1.345 . . . . 0.0 113.74 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.37 -23.53 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 118.773 0.715 . . . . 0.0 112.809 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.2 mt -80.02 -52.2 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.165 0.986 . . . . 0.0 110.189 173.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -54.33 -51.77 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.817 0.847 . . . . 0.0 110.489 175.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -64.73 -25.6 68.0 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.434 -0.791 . . . . 0.0 112.31 -178.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.83 -48.78 14.1 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.996 -1.002 . . . . 0.0 113.134 172.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -27.58 69.08 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 121.485 1.948 . . . . 0.0 113.851 174.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -70.22 -29.17 65.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.829 1.651 . . . . 0.0 114.032 168.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -133.91 69.91 74.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.706 1.202 . . . . 0.0 112.304 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -55.41 -16.57 14.13 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.232 2.621 . . . . 0.0 116.356 -176.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -85.65 -27.03 25.66 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -64.33 161.3 17.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.156 0.982 . . . . 0.0 112.661 -175.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -81.22 142.0 33.61 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.856 -0.527 . . . . 0.0 110.1 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.87 -35.81 69.33 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.018 0.927 . . . . 0.0 113.34 171.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.413 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -84.85 -28.25 26.18 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -171.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.2 t -62.48 -17.35 59.35 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.132 -0.98 . . . . 0.0 112.085 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -62.66 -6.63 3.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 119.722 -1.861 . . . . 0.0 113.929 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.09 72.5 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.239 1.416 . . . . 0.0 111.665 167.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -30.77 67.46 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -167.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -73.3 -30.16 63.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.814 1.246 . . . . 0.0 113.854 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.29 0 C-N-CA 124.449 1.1 . . . . 0.0 112.183 -167.68 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -92.97 95.59 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.752 -1.218 . . . . 0.0 113.786 -166.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.88 -36.77 59.61 Favored 'General case' 0 CA--C 1.558 1.277 0 O-C-N 121.16 -0.962 . . . . 0.0 109.932 168.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.408 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 25.2 mtmt -67.99 -12.71 61.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 128.89 2.876 . . . . 0.0 116.284 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -133.21 19.04 4.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.5 ttm -59.78 123.85 18.27 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 169.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -78.04 154.64 31.23 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.34 -0.85 . . . . 0.0 110.327 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.0 m -61.45 -35.09 76.63 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 120.482 -1.386 . . . . 0.0 112.596 -173.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -65.64 -32.33 73.85 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.306 0.957 . . . . 0.0 112.725 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -76.23 -37.83 57.18 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.03 1.332 . . . . 0.0 111.344 174.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -63.95 -49.43 72.6 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.944 0.898 . . . . 0.0 112.614 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.19 -2.99 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -110.79 -8.59 14.53 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.606 1.962 . . . . 0.0 114.089 172.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.6 156.89 35.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.747 1.158 . . . . 0.0 110.177 172.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -66.43 127.53 93.37 Favored Pre-proline 0 N--CA 1.479 0.986 0 O-C-N 121.3 -0.875 . . . . 0.0 109.662 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -46.77 -32.18 11.82 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.683 2.922 . . . . 0.0 113.819 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.517 ' HG2' ' H ' ' A' ' 4' ' ' SER . 57.8 mttt -60.11 -13.82 13.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . 0.477 ' HB2' ' HE1' ' A' ' 8' ' ' MET . . . -132.94 22.59 4.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 121.421 1.919 . . . . 0.0 113.123 165.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ttm -67.57 -54.77 17.11 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.677 1.191 . . . . 0.0 111.295 170.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.0 m -48.09 -55.7 17.04 Favored Pre-proline 0 N--CA 1.49 1.54 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.68 -45.42 40.49 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.124 3.216 . . . . 0.0 115.543 174.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.32 -39.99 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.391 1.451 . . . . 0.0 112.935 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.23 -31.86 71.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.185 0.594 . . . . 0.0 110.68 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 67.3 t90 -78.78 -48.61 14.49 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.541 172.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.41 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.7 t90 -64.67 -25.88 68.14 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 117.888 -1.525 . . . . 0.0 110.957 -171.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -62.0 -60.38 3.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.118 1.367 . . . . 0.0 111.17 167.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.542 0.67 0 C-N-CA 125.143 1.377 . . . . 0.0 113.423 -170.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 CA--C 1.535 0.4 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.02 -30.44 61.88 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.1 m -81.91 -33.87 30.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.811 0.845 . . . . 0.0 112.347 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -83.17 -31.94 26.86 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.766 -1.112 . . . . 0.0 113.76 -177.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.82 -47.03 86.92 Favored Pre-proline 0 N--CA 1.481 1.1 0 CA-C-N 120.433 1.47 . . . . 0.0 113.038 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.31 -37.64 17.37 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 122.208 1.824 . . . . 0.0 113.318 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -65.42 -36.83 85.11 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.776 -1.203 . . . . 0.0 113.152 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 m -73.25 -28.44 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.777 -0.577 . . . . 0.0 112.49 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 49.7 mt -66.17 -49.23 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-N 118.191 0.45 . . . . 0.0 109.894 170.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.31 -41.61 80.24 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.406 0.683 . . . . 0.0 111.904 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -66.6 -27.53 67.78 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.517 -0.74 . . . . 0.0 112.923 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -76.07 -48.36 21.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.846 0.858 . . . . 0.0 112.184 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -26.47 68.28 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.979 1.263 . . . . 0.0 114.294 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.279 15.2 ptpt -83.73 -10.45 58.12 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 169.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -138.32 61.73 27.35 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.655 1.582 . . . . 0.0 111.439 174.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.81 -14.63 33.16 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.801 3.001 . . . . 0.0 115.847 -169.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -84.99 -14.54 47.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 113.681 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -77.33 160.09 29.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.681 1.192 . . . . 0.0 112.147 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -77.84 139.83 39.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.551 -0.718 . . . . 0.0 109.3 169.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -54.18 -35.76 62.66 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.089 0.956 . . . . 0.0 112.875 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.408 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -87.16 -23.03 24.96 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -170.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.1 t -64.24 -14.61 56.72 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 120.771 -1.206 . . . . 0.0 112.018 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -66.06 -5.17 8.87 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.487 -2.008 . . . . 0.0 114.18 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.01 -30.05 49.84 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 119.929 1.241 . . . . 0.0 111.565 166.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -64.98 -33.68 76.61 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.921 1.289 . . . . 0.0 112.037 -171.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -73.07 -28.8 62.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.528 1.931 . . . . 0.0 115.647 173.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -166.255 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.461 ' HB3' ' HE3' ' B' ' 98' ' ' LYS . 20.2 mm-40 . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 117.923 -1.037 . . . . 0.0 113.164 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 101.92 100.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 129.462 3.105 . . . . 0.0 114.919 168.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.73 -33.55 73.07 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.313 -1.492 . . . . 0.0 112.588 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.427 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.3 ptpt -74.31 -12.46 60.55 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -106.02 6.08 30.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.452 1.101 . . . . 0.0 112.594 168.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 43.0 ttm -62.02 129.31 40.3 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.724 -1.235 . . . . 0.0 109.722 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.88 155.12 27.92 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.049 -1.032 . . . . 0.0 110.481 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.88 -32.61 74.19 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.264 -1.522 . . . . 0.0 113.417 -175.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.86 -31.47 71.74 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -81.22 -35.0 31.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.39 1.476 . . . . 0.0 111.53 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -57.94 -50.45 73.31 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 121.562 -0.711 . . . . 0.0 112.658 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -69.57 -0.66 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 125.262 1.425 . . . . 0.0 113.042 177.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -111.54 -11.28 14.08 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.351 1.46 . . . . 0.0 114.318 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.42 165.99 24.04 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.188 -0.945 . . . . 0.0 111.622 174.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.423 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 49.9 t-20 -65.74 128.72 94.02 Favored Pre-proline 0 N--CA 1.483 1.191 0 O-C-N 120.941 -1.099 . . . . 0.0 112.542 -177.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 34.2 Cg_exo -57.65 -12.74 12.15 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.556 3.504 . . . . 0.0 116.521 177.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 9.3 mttt -65.75 -67.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.029 1.731 . . . . 0.0 109.672 166.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.64 -6.47 52.18 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 73.6 mtp -57.06 -30.74 64.53 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 121.009 -1.057 . . . . 0.0 112.155 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.267 23.7 m -68.15 -56.1 11.62 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.67 -36.62 82.09 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 123.173 2.582 . . . . 0.0 114.768 168.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.405 HG22 ' HG2' ' B' ' 102' ' ' PRO . 66.2 t -63.74 -53.97 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.504 0.593 . . . . 0.0 111.067 175.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.3 71.37 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.786 1.235 . . . . 0.0 111.685 -177.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.0 t90 -77.68 -52.74 8.49 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 117.575 -1.203 . . . . 0.0 113.459 169.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.494 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 3.0 t90 -66.44 -34.22 77.45 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.761 1.619 . . . . 0.0 111.886 -167.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 58.0 ttp -54.3 -44.2 71.78 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.958 0.903 . . . . 0.0 112.115 169.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.556 0 C-N-CA 125.281 1.432 . . . . 0.0 112.909 -171.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 CA--C 1.533 0.323 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.5 mt -64.24 -25.24 67.97 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.892 -1.13 . . . . 0.0 112.219 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.8 m -77.83 -35.49 51.11 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.701 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -88.49 -27.81 21.23 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.06 -43.64 85.18 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.913 174.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.69 -40.36 10.13 Favored 'Trans proline' 0 C--N 1.352 0.726 0 CA-C-N 122.16 1.807 . . . . 0.0 113.572 169.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -63.35 -37.23 86.48 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.954 1.252 . . . . 0.0 112.928 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 m -68.97 -28.38 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -72.31 -51.43 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 173.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.99 -43.09 77.31 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.141 0.977 . . . . 0.0 111.415 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.29 -30.49 69.51 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.831 -0.543 . . . . 0.0 111.375 -177.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.77 -42.7 57.67 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.11 -0.994 . . . . 0.0 112.807 174.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -31.08 68.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.764 1.62 . . . . 0.0 114.284 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -82.6 -25.71 32.97 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -130.9 73.95 80.5 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.767 1.627 . . . . 0.0 110.603 170.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.52 -11.45 16.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.731 3.621 . . . . 0.0 115.722 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -81.92 -25.14 35.18 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.806 1.642 . . . . 0.0 112.613 -175.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -66.41 154.61 39.69 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.114 0.966 . . . . 0.0 111.395 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -89.62 127.42 35.9 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 174.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.26 -51.5 10.77 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -166.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.427 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -70.92 -6.74 40.75 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.5 p -56.74 -28.21 60.69 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 120.75 -1.219 . . . . 0.0 110.969 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -71.16 -2.26 15.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.515 1.526 . . . . 0.0 114.307 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -83.41 -31.08 26.85 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 111.811 167.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -69.5 -28.69 66.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 111.94 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -75.63 -31.53 59.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.624 1.57 . . . . 0.0 114.988 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 112.425 -166.858 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.428 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 20.8 mm-40 . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m 117.99 78.91 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 130.885 3.674 . . . . 0.0 112.665 170.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.4 -39.37 70.11 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.156 -1.59 . . . . 0.0 111.905 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.444 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 2.3 ptpt -78.82 3.63 16.24 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -124.97 9.88 8.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.8 1.24 . . . . 0.0 112.2 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 37.6 ttm -61.5 124.7 21.37 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.476 1.034 . . . . 0.0 109.427 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -76.69 153.24 35.31 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.757 -0.589 . . . . 0.0 110.008 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.93 -28.27 68.16 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.323 -1.486 . . . . 0.0 113.88 -170.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -67.23 -31.85 72.48 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 118.806 0.73 . . . . 0.0 112.551 169.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -75.71 -37.96 59.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.004 1.322 . . . . 0.0 111.28 176.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -67.85 -4.83 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.99 -10.34 17.29 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.957 1.703 . . . . 0.0 113.886 172.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.67 157.77 37.4 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.81 1.187 . . . . 0.0 111.199 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.64 134.75 89.23 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 123.603 0.761 . . . . 0.0 113.036 -178.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -72.59 -7.19 20.42 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.719 1.612 . . . . 0.0 115.947 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' A' ' 3' ' ' GLU . 6.3 mptt -71.3 -53.79 13.05 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.926 1.694 . . . . 0.0 108.712 167.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.32 -15.6 54.92 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 36.3 ttm -54.03 -33.33 57.01 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.636 -0.665 . . . . 0.0 112.6 172.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 30.9 m -65.4 -58.24 12.59 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.773 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . 0.405 ' HG2' HG22 ' A' ' 24' ' ' VAL . 7.5 Cg_endo -51.79 -41.98 59.64 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 124.053 3.168 . . . . 0.0 115.033 172.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.92 -42.49 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.637 1.108 . . . . 0.0 113.034 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.69 -29.08 69.85 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.2 t90 -77.56 -51.9 9.93 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 117.728 -1.13 . . . . 0.0 112.16 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -65.84 -29.24 69.67 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.801 1.637 . . . . 0.0 111.21 -169.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 2.8 ttp -65.82 -39.25 90.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.726 1.61 . . . . 0.0 111.895 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tm? . . . . . 0 CA--C 1.54 0.584 0 C-N-CA 124.543 1.137 . . . . 0.0 112.43 -177.83 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 22.0 t70 . . . . . 0 CA--C 1.539 0.556 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 pp -62.05 -27.27 68.78 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 21.8 m -81.28 -31.49 33.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 122.502 0.321 . . . . 0.0 111.504 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -84.06 -26.1 29.31 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.389 -1.291 . . . . 0.0 114.472 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.16 -42.28 79.81 Favored Pre-proline 0 N--CA 1.482 1.15 0 CA-C-N 121.533 1.969 . . . . 0.0 113.983 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.44 -36.02 5.71 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 CA-C-N 122.487 1.924 . . . . 0.0 113.255 169.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -67.88 -30.78 70.23 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.697 -1.252 . . . . 0.0 113.923 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.0 m -70.9 -31.21 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.989 0.813 . . . . 0.0 111.431 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -68.15 -50.66 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 109.864 171.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -55.19 -44.65 75.48 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.852 0.861 . . . . 0.0 111.571 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.17 -37.03 84.64 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.458 1.026 . . . . 0.0 111.888 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.9 -36.66 78.31 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.456 -0.777 . . . . 0.0 112.189 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -58.3 -51.21 70.73 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.43 1.492 . . . . 0.0 112.648 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 pttt -84.87 -21.58 29.71 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -128.92 76.87 78.65 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.896 1.679 . . . . 0.0 109.672 170.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.09 -9.69 22.72 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.895 3.064 . . . . 0.0 114.957 -176.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -81.96 -21.44 37.2 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.312 1.445 . . . . 0.0 112.833 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -70.37 159.65 33.75 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.441 1.097 . . . . 0.0 111.992 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -92.66 130.26 38.35 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 169.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 65.6 tp -45.33 -47.41 13.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.999 1.32 . . . . 0.0 114.244 -172.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.444 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -72.53 -8.76 56.79 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -174.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 70.3 p -60.53 -24.53 65.44 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.677 -1.264 . . . . 0.0 111.61 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -72.43 -1.18 14.7 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.831 1.253 . . . . 0.0 114.26 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -80.73 -31.85 35.89 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.663 1.12 . . . . 0.0 111.572 165.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -68.75 -29.05 67.37 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.709 1.204 . . . . 0.0 112.465 -169.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.94 -30.01 68.37 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 114.115 169.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.566 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -168.935 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 . . . . . 0 CA--C 1.544 0.729 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.5 m 90.69 99.76 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 129.685 3.194 . . . . 0.0 117.808 165.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.99 -32.4 66.06 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 119.87 -1.769 . . . . 0.0 111.861 169.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 32.0 mttt -58.92 -22.81 60.44 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 126.989 2.116 . . . . 0.0 114.86 175.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -119.29 6.01 11.2 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.895 1.678 . . . . 0.0 112.756 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -61.84 127.41 31.27 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.924 -1.11 . . . . 0.0 109.755 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.58 155.19 28.26 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.292 -0.88 . . . . 0.0 110.022 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.39 -33.84 76.43 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 120.454 -1.404 . . . . 0.0 113.187 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -64.09 -32.24 73.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.774 0.716 . . . . 0.0 112.881 172.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -77.22 -38.18 51.79 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.885 1.274 . . . . 0.0 111.836 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -59.09 -50.37 74.31 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.818 0.847 . . . . 0.0 112.438 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.1 pt -68.36 -5.07 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 124.454 1.102 . . . . 0.0 112.925 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -105.75 -8.98 17.5 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.735 1.614 . . . . 0.0 113.543 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.14 157.89 33.94 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 119.758 1.163 . . . . 0.0 110.462 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -66.83 129.74 94.03 Favored Pre-proline 0 N--CA 1.482 1.132 0 O-C-N 121.216 -0.927 . . . . 0.0 111.426 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -52.17 -27.82 31.18 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.385 2.723 . . . . 0.0 115.019 177.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -51.32 -66.5 0.37 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.769 1.628 . . . . 0.0 111.078 170.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.255 . . -83.07 -4.55 58.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 178.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.2 ttt -64.65 -36.55 84.61 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.857 -1.152 . . . . 0.0 112.211 168.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.9 m -60.45 -51.83 77.22 Favored Pre-proline 0 N--CA 1.478 0.939 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.4 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 10.0 Cg_endo -54.94 -46.3 34.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.16 2.573 . . . . 0.0 115.309 169.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.96 -35.52 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 119.765 1.166 . . . . 0.0 113.154 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.12 -18.34 64.33 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.45 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.2 t90 -95.69 -48.6 5.72 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.181 0.901 . . . . 0.0 111.665 168.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.512 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 56.6 t-105 -64.24 -34.58 78.43 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.563 1.145 . . . . 0.0 111.922 -170.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.2 tmm? -67.18 -46.78 72.93 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 124.831 1.252 . . . . 0.0 111.385 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 124.775 1.23 . . . . 0.0 112.749 -169.288 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.3 t70 . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 111.198 0.073 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.1 -27.37 69.35 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.056 -1.027 . . . . 0.0 112.436 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.0 m -76.39 -35.39 58.65 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.405 1.082 . . . . 0.0 111.615 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.53 -28.17 31.21 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.453 1.024 . . . . 0.0 113.642 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.256 1.5 mp -52.93 -40.68 80.45 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.301 1.41 . . . . 0.0 113.628 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.44 -37.01 3.47 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 122.225 1.83 . . . . 0.0 113.175 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -64.57 -34.3 77.94 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.302 -1.499 . . . . 0.0 113.65 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.74 -15.85 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 174.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.0 mt -91.38 -51.27 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.456 1.102 . . . . 0.0 110.663 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.5 -48.39 71.92 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.942 0.897 . . . . 0.0 110.321 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -65.26 -23.57 67.08 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.282 -0.886 . . . . 0.0 112.62 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.7 -48.42 13.7 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.309 0.959 . . . . 0.0 112.668 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.8 -27.17 69.0 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 120.851 1.66 . . . . 0.0 113.892 174.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -72.5 -31.0 65.01 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.67 1.588 . . . . 0.0 114.884 169.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -130.81 64.52 73.84 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.173 1.389 . . . . 0.0 111.369 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -59.51 -14.87 27.54 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 124.267 3.311 . . . . 0.0 115.726 -172.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -84.61 -20.85 30.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.604 1.562 . . . . 0.0 113.797 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -73.46 162.27 29.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.993 1.317 . . . . 0.0 112.248 -172.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -77.68 154.1 32.45 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.923 -0.486 . . . . 0.0 110.04 169.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.36 -36.7 77.1 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.28 -0.887 . . . . 0.0 113.382 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.3 m-85 -88.05 -21.09 24.95 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 -168.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.3 t -59.16 -22.17 60.53 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.285 -0.884 . . . . 0.0 111.549 170.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -58.67 -16.46 16.4 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 119.555 -1.966 . . . . 0.0 113.394 171.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -58.07 -34.57 70.27 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.31 0.959 . . . . 0.0 112.473 167.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -25.6 67.98 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.962 0.887 . . . . 0.0 112.303 -169.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.344 2.258 . . . . 0.0 113.616 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.738 0 C-N-CA 125.083 1.353 . . . . 0.0 112.731 -166.932 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.321 33.3 mm-40 . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 70.7 m 107.48 79.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 131.205 3.802 . . . . 0.0 114.017 167.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.7 -41.49 61.49 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 121.068 -1.02 . . . . 0.0 110.837 172.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.443 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 13.8 mtmt -63.19 -15.1 55.86 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.299 2.239 . . . . 0.0 115.809 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -123.85 7.72 8.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.456 1.502 . . . . 0.0 112.799 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 31.0 ttm -59.6 125.25 22.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.765 1.166 . . . . 0.0 109.353 174.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.56 153.76 33.03 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 -178.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.93 -32.49 73.79 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.427 -1.421 . . . . 0.0 112.8 -173.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -66.52 -30.88 71.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.968 0.804 . . . . 0.0 112.89 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -77.5 -38.69 48.51 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.794 1.238 . . . . 0.0 111.315 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.76 -51.27 70.46 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.486 0.714 . . . . 0.0 112.316 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.2 pt -68.27 -3.29 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.832 0.853 . . . . 0.0 112.861 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -105.72 -9.12 17.45 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 126.053 1.741 . . . . 0.0 114.112 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.57 158.13 36.76 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.828 1.195 . . . . 0.0 111.065 174.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.408 HD21 ' HD2' ' B' ' 98' ' ' LYS . 49.0 t-20 -67.82 132.49 92.39 Favored Pre-proline 0 N--CA 1.485 1.283 0 O-C-N 121.04 -1.037 . . . . 0.0 112.128 -173.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -57.29 -16.91 24.15 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.829 3.019 . . . . 0.0 115.829 175.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.2 mttt -61.89 -64.11 1.04 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.0 1.72 . . . . 0.0 109.458 166.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.2 -4.18 56.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -177.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.8 mmt -52.42 -45.42 65.93 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.61 1.096 . . . . 0.0 111.704 168.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 83.3 m -60.88 -52.8 69.74 Favored Pre-proline 0 N--CA 1.48 1.05 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.877 -172.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -49.87 -49.46 15.96 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.232 3.288 . . . . 0.0 115.202 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.2 p -72.4 -36.41 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 119.485 1.039 . . . . 0.0 112.934 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.98 67.43 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.518 1.127 . . . . 0.0 111.35 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.523 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.6 t90 -84.21 -53.83 5.23 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 117.826 -1.083 . . . . 0.0 110.883 166.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.523 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.9 t90 -62.29 -33.03 73.87 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 116.495 -2.082 . . . . 0.0 113.159 -164.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -59.72 -42.57 93.38 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.225 1.01 . . . . 0.0 112.635 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.545 0.763 0 C-N-CA 126.525 1.93 . . . . 0.0 112.435 -172.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 . . . . . 0 N--CA 1.468 0.442 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -56.32 -30.18 62.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.385 0.674 . . . . 0.0 112.259 173.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.6 m -79.7 -39.4 31.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.222 1.009 . . . . 0.0 112.092 172.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -70.89 -36.67 72.85 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.512 -1.368 . . . . 0.0 113.545 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.97 -41.95 90.66 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.592 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -76.0 -35.47 2.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.094 1.863 . . . . 0.0 113.653 169.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -67.22 -28.05 67.74 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.189 -1.569 . . . . 0.0 114.166 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.1 m -71.2 -24.72 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.843 -0.536 . . . . 0.0 112.035 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 36.7 mt -74.22 -47.95 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.196 0.999 . . . . 0.0 109.965 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -54.65 -48.27 72.51 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.745 0.818 . . . . 0.0 112.029 172.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -68.0 -24.74 65.16 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.792 -1.193 . . . . 0.0 112.151 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -76.54 -47.67 21.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 118.422 -0.799 . . . . 0.0 112.626 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 120.826 1.648 . . . . 0.0 114.047 176.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -69.45 -30.37 68.27 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 167.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -133.7 64.79 69.11 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.975 1.31 . . . . 0.0 112.395 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -58.7 -16.73 32.16 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.101 2.534 . . . . 0.0 116.704 -170.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -83.24 -15.02 51.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.998 1.319 . . . . 0.0 113.347 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.04 162.36 28.11 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.891 1.277 . . . . 0.0 112.007 -172.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -76.98 157.09 31.45 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -73.0 -48.45 36.23 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 174.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.443 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.1 m-85 -77.86 -18.06 56.66 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 116.161 1.911 . . . . 0.0 116.161 -168.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.2 t -58.88 -24.2 61.93 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.383 -0.823 . . . . 0.0 111.686 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -61.51 -4.1 1.22 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 119.787 -1.82 . . . . 0.0 114.242 171.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -71.21 -31.92 68.17 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.705 1.139 . . . . 0.0 112.168 166.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -63.11 -34.13 76.95 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -168.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -70.13 -26.27 63.87 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.824 2.05 . . . . 0.0 114.766 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.635 0 C-N-CA 125.432 1.493 . . . . 0.0 113.204 -168.338 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 . . . . . 0 N--CA 1.469 0.525 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t 80.26 117.5 0.06 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.601 2.761 . . . . 0.0 117.439 167.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.16 -25.41 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.314 -0.866 . . . . 0.0 113.17 175.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -59.82 -30.26 68.8 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.603 1.561 . . . . 0.0 113.097 177.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -107.6 4.62 26.12 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.062 1.745 . . . . 0.0 113.144 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.1 ttm -64.62 124.84 22.93 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.855 -1.153 . . . . 0.0 110.374 175.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.81 155.68 27.75 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.013 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -62.35 -34.38 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.57 -1.331 . . . . 0.0 112.898 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -60.47 -32.03 71.02 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 171.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -82.37 -37.63 25.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.265 1.426 . . . . 0.0 111.602 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.42 -48.39 81.84 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.641 0.777 . . . . 0.0 112.61 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -68.27 -3.66 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 124.18 0.992 . . . . 0.0 112.618 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -111.99 -4.8 14.41 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 125.627 1.571 . . . . 0.0 114.148 176.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.78 159.44 32.92 Favored 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.78 -1.2 . . . . 0.0 111.389 177.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -54.01 134.02 58.5 Favored Pre-proline 0 N--CA 1.484 1.227 0 C-N-CA 124.81 1.244 . . . . 0.0 113.8 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.48 -15.49 41.8 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.085 2.523 . . . . 0.0 116.223 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HB2' ' HE2' ' B' ' 87' ' ' MET . 7.2 mptt -71.08 -55.51 8.08 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 120.759 1.618 . . . . 0.0 109.331 170.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.44 -0.18 48.95 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -175.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.76 -40.42 95.08 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.256 23.2 m -66.94 -50.95 40.36 Favored Pre-proline 0 N--CA 1.481 1.093 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -175.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.1 -42.13 47.02 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.607 2.871 . . . . 0.0 115.538 169.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.2 p -73.64 -40.75 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.432 1.014 . . . . 0.0 113.241 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.75 66.65 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.754 0.822 . . . . 0.0 111.494 174.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.494 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 76.7 t90 -87.97 -50.48 6.39 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.05 -1.452 . . . . 0.0 112.104 168.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.42 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 2.0 t90 -67.62 -26.9 66.47 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 121.685 2.039 . . . . 0.0 112.12 -168.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.41 -43.01 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.663 0.785 . . . . 0.0 111.777 169.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.546 0.809 0 C-N-CA 125.812 1.645 . . . . 0.0 111.766 -176.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 . . . . . 0 C--O 1.221 -0.442 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.02 -21.52 66.54 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 120.969 -1.082 . . . . 0.0 112.207 177.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.4 m -81.48 -37.42 27.95 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.987 0.915 . . . . 0.0 111.438 169.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -83.74 -28.07 28.48 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.776 1.171 . . . . 0.0 113.864 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.27 -42.88 96.22 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 119.985 1.266 . . . . 0.0 112.152 176.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.53 -35.5 10.3 Favored 'Trans proline' 0 C--N 1.353 0.788 0 CA-C-N 122.145 1.802 . . . . 0.0 113.269 169.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -66.1 -36.33 82.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.109 -1.62 . . . . 0.0 113.671 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.12 -20.78 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.798 0.727 . . . . 0.0 112.573 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 39.3 mt -82.34 -50.67 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.062 0.945 . . . . 0.0 110.558 171.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.25 -38.71 77.43 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 123.853 0.861 . . . . 0.0 111.9 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -69.41 -29.09 66.75 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.954 0.502 . . . . 0.0 111.601 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.6 m -77.19 -46.27 23.88 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.922 174.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -29.47 68.41 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.974 1.716 . . . . 0.0 114.159 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -75.64 -29.08 59.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -134.66 74.63 64.67 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.971 1.309 . . . . 0.0 111.871 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -58.37 -12.44 13.56 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.442 3.428 . . . . 0.0 117.445 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -79.63 -23.95 42.25 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.884 1.273 . . . . 0.0 113.401 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt -64.85 154.66 36.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.37 1.068 . . . . 0.0 112.085 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -80.99 151.58 28.39 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.427 -0.796 . . . . 0.0 109.622 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.0 tp -66.33 -36.55 83.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.86 -1.15 . . . . 0.0 113.132 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.45 -20.94 30.93 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -64.27 -14.54 56.47 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.214 -0.929 . . . . 0.0 112.288 169.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -66.78 -3.52 6.95 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 119.156 -2.215 . . . . 0.0 113.906 169.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -32.77 56.18 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.71 1.204 . . . . 0.0 111.199 165.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -65.69 -29.93 70.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.69 1.596 . . . . 0.0 112.279 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -74.24 -29.61 61.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.579 1.552 . . . . 0.0 114.765 174.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 124.927 1.291 . . . . 0.0 113.767 -167.719 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 . . . . . 0 N--CA 1.443 -0.784 0 N-CA-C 104.431 -2.433 . . . . 0.0 104.431 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 69.5 m -86.43 91.78 8.63 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.808 1.643 . . . . 0.0 113.378 -165.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.91 -35.67 64.39 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 120.385 -1.447 . . . . 0.0 110.789 170.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.475 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 18.2 mtmt -76.5 -4.33 42.09 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.303 2.241 . . . . 0.0 115.942 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -134.72 17.26 3.58 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.719 1.208 . . . . 0.0 112.207 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . 0.457 ' HE2' ' HB2' ' A' ' 19' ' ' LYS . 58.6 ttm -59.63 134.44 57.02 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 121.292 -0.88 . . . . 0.0 108.711 170.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -72.02 166.94 21.2 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.468 1.128 . . . . 0.0 112.176 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.69 -31.27 68.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.212 170.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -65.45 -38.36 89.61 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.055 0.843 . . . . 0.0 112.397 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -68.76 -41.57 78.7 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 121.459 -0.776 . . . . 0.0 112.094 172.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -59.46 -47.71 84.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.616 0.644 . . . . 0.0 111.947 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -71.27 -13.26 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.676 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.46 -24.42 20.71 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.467 1.031 . . . . 0.0 113.547 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.03 155.47 36.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.38 1.072 . . . . 0.0 112.139 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.567 HD21 ' HD2' ' B' ' 98' ' ' LYS . 36.7 t30 -75.16 139.4 72.45 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -65.58 -16.5 54.0 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 121.918 1.745 . . . . 0.0 116.238 -172.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.567 ' HD2' HD21 ' B' ' 96' ' ' ASN . 6.2 mptt -60.08 -61.11 2.85 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.672 -1.268 . . . . 0.0 110.46 168.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.1 -8.99 57.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -177.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -57.31 -40.66 78.35 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.02 -1.05 . . . . 0.0 110.911 168.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.5 m -57.87 -57.77 23.3 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.39 1.076 . . . . 0.0 113.113 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.78 -40.54 79.73 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 124.12 3.213 . . . . 0.0 115.791 172.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -76.8 -36.56 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 CA-C-N 120.717 1.599 . . . . 0.0 113.355 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.02 -29.48 69.74 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.755 0.822 . . . . 0.0 111.03 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.518 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 67.5 t90 -80.06 -53.05 7.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 117.869 -1.062 . . . . 0.0 112.772 169.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.518 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.17 -30.05 70.44 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 117.909 -1.516 . . . . 0.0 111.305 -168.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -58.56 -34.5 71.12 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.705 0.802 . . . . 0.0 112.896 171.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mm? . . . . . 0 CA--C 1.548 0.873 0 C-N-CA 126.442 1.897 . . . . 0.0 114.468 178.615 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.2 mt -56.83 -31.53 64.83 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.812 0.845 . . . . 0.0 112.544 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 38.1 m -80.71 -35.98 32.82 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.928 0.891 . . . . 0.0 112.144 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -81.73 -30.01 32.66 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.93 -40.51 72.4 Favored Pre-proline 0 CA--C 1.555 1.148 0 CA-C-N 120.525 1.511 . . . . 0.0 113.723 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -74.05 -37.46 2.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 CA-C-N 122.067 1.774 . . . . 0.0 113.632 169.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -67.68 -30.27 69.75 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 120.372 -1.455 . . . . 0.0 114.181 -174.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -67.64 -24.22 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.584 . . . . 0.0 112.379 173.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 48.9 mt -72.87 -53.16 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.209 1.004 . . . . 0.0 109.734 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -55.26 -53.74 52.24 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.469 0.707 . . . . 0.0 110.967 176.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.81 -24.96 67.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.191 -0.943 . . . . 0.0 112.816 -177.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -78.82 -47.62 16.31 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.648 1.113 . . . . 0.0 112.314 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -25.28 67.94 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 120.93 1.695 . . . . 0.0 113.463 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -74.81 -26.85 60.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.455 1.502 . . . . 0.0 114.959 169.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -135.85 62.49 47.39 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.331 1.453 . . . . 0.0 110.871 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.47 -16.0 39.42 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.577 2.851 . . . . 0.0 114.773 -171.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -78.39 -23.88 46.58 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.973 1.709 . . . . 0.0 114.283 -177.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -67.1 164.42 18.0 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.27 1.428 . . . . 0.0 112.901 -173.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.37 131.04 37.12 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 168.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.6 tp -46.03 -37.99 7.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.739 1.616 . . . . 0.0 113.728 179.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 7.2 m-85 -78.31 -8.64 58.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.0 p -65.44 -24.3 67.15 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 120.786 -1.197 . . . . 0.0 111.636 168.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -72.97 -2.48 21.18 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -80.04 -32.11 39.51 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.663 1.12 . . . . 0.0 111.632 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -68.33 -30.85 69.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.744 0.818 . . . . 0.0 112.078 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -73.34 -28.56 62.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.258 1.823 . . . . 0.0 115.253 169.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.479 0 C-N-CA 125.189 1.395 . . . . 0.0 114.021 -165.773 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.407 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 19.8 mm-40 . . . . . 0 N--CA 1.472 0.635 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.201 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 t 100.24 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.261 3.024 . . . . 0.0 115.138 169.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.79 -26.28 68.56 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.073 -1.642 . . . . 0.0 111.01 169.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HD3' ' CE1' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -67.15 -20.26 65.72 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.961 2.104 . . . . 0.0 113.782 175.452 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -115.58 5.2 14.31 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.937 1.295 . . . . 0.0 113.29 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.1 ttm -62.62 123.24 17.84 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.017 -1.052 . . . . 0.0 109.977 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -79.17 155.4 28.67 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.227 -0.921 . . . . 0.0 110.695 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.11 -34.97 75.8 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.604 -1.31 . . . . 0.0 112.831 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -61.62 -33.38 73.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.95 0.796 . . . . 0.0 112.95 172.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -78.63 -37.36 42.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.994 1.318 . . . . 0.0 111.607 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.81 -49.64 76.91 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.613 0.765 . . . . 0.0 112.409 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.6 pt -68.38 -5.87 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.324 1.05 . . . . 0.0 112.896 177.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -105.16 -8.84 18.13 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.412 1.485 . . . . 0.0 113.494 174.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.36 159.87 31.8 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 120.957 -1.089 . . . . 0.0 111.203 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -67.64 130.08 93.23 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.039 -1.038 . . . . 0.0 112.187 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.79 -16.99 12.48 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.809 3.673 . . . . 0.0 116.396 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HG3' ' C ' ' B' ' 82' ' ' GLU . 11.9 mttt -64.4 -67.62 0.42 Allowed 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.813 2.045 . . . . 0.0 108.649 166.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.84 -10.45 59.51 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.38 -34.91 73.0 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.272 19.1 m -66.3 -52.65 36.24 Favored Pre-proline 0 N--CA 1.481 1.081 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -50.98 -43.95 44.81 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.368 2.712 . . . . 0.0 115.469 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.3 p -73.04 -38.45 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-N 119.218 0.917 . . . . 0.0 113.095 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.21 -20.51 66.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.254 1.022 . . . . 0.0 111.783 174.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.474 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 58.4 t90 -88.65 -51.2 5.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.81 168.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.426 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 1.9 t90 -69.2 -31.08 69.44 Favored 'General case' 0 C--N 1.351 0.63 0 CA-C-N 120.025 1.284 . . . . 0.0 112.252 -168.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -63.92 -43.84 94.7 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.625 0.77 . . . . 0.0 110.995 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 CA--C 1.542 0.652 0 C-N-CA 124.592 1.157 . . . . 0.0 112.802 -173.208 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.465 0.324 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.07 -22.3 66.94 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.129 -0.982 . . . . 0.0 111.812 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.9 m -79.17 -36.87 39.66 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.172 0.989 . . . . 0.0 111.67 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -82.65 -33.59 27.74 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.551 -1.343 . . . . 0.0 113.876 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.43 -42.38 87.28 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.696 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.41 -37.93 7.0 Favored 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 122.119 1.793 . . . . 0.0 113.385 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -67.02 -34.45 77.75 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.149 -1.594 . . . . 0.0 113.68 -176.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.6 m -67.52 -16.2 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 173.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.7 mt -90.58 -50.73 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.221 1.408 . . . . 0.0 110.687 172.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.28 -39.14 78.46 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.309 1.043 . . . . 0.0 111.482 177.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -70.14 -24.29 63.15 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.14 -0.975 . . . . 0.0 111.52 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.82 -44.8 17.91 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.999 0.92 . . . . 0.0 112.031 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -27.69 69.37 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 120.666 1.575 . . . . 0.0 113.526 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -69.56 -35.12 75.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 168.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -130.04 65.78 76.21 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.682 1.193 . . . . 0.0 112.263 -178.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -55.71 -14.43 10.43 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.53 2.82 . . . . 0.0 117.033 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -84.85 -21.41 29.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.375 1.47 . . . . 0.0 113.65 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -70.07 158.32 35.92 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.327 1.051 . . . . 0.0 111.981 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -94.91 133.37 38.72 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.4 tp -49.64 -42.81 46.07 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -168.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CE1' ' HD3' ' A' ' 6' ' ' LYS . 7.5 m-85 -75.0 -8.56 56.86 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -178.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 69.0 p -60.41 -27.37 67.4 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.349 -1.47 . . . . 0.0 111.517 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -72.87 -3.85 28.22 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.76 1.224 . . . . 0.0 113.7 177.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -79.73 -30.95 41.05 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.338 0.972 . . . . 0.0 111.747 168.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -69.71 -26.03 64.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.72 1.208 . . . . 0.0 112.243 -170.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -76.88 -31.82 57.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.843 1.657 . . . . 0.0 114.872 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.503 0 C-N-CA 124.304 1.042 . . . . 0.0 113.658 -167.705 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.407 ' C ' ' HG3' ' A' ' 19' ' ' LYS . 34.9 mm-40 . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.1 t 101.62 95.09 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.68 3.192 . . . . 0.0 116.305 168.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.22 -37.39 77.38 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.339 -1.476 . . . . 0.0 112.202 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.3 ptpt -76.01 -13.22 60.23 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -107.92 7.26 27.91 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.656 1.183 . . . . 0.0 113.051 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 40.5 ttm -62.55 128.66 37.02 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.795 -1.19 . . . . 0.0 109.829 173.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -77.17 154.55 33.04 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 120.929 -1.107 . . . . 0.0 110.744 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.16 -33.67 74.95 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.225 -1.547 . . . . 0.0 113.277 -174.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -30.79 71.15 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 119.171 0.896 . . . . 0.0 112.22 173.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -76.54 -37.23 56.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.677 1.191 . . . . 0.0 111.504 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.25 -49.63 76.33 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.418 -0.801 . . . . 0.0 113.022 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 9.0 pt -66.61 -8.86 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -102.08 -12.14 18.33 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.114 1.766 . . . . 0.0 114.015 173.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.51 157.73 37.35 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.616 1.098 . . . . 0.0 111.45 176.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.449 HD21 ' CD ' ' B' ' 98' ' ' LYS . 1.7 t-20 -57.51 134.66 82.06 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.421 1.088 . . . . 0.0 113.458 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 13.6 Cg_exo -75.92 -6.32 17.3 Favored 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 121.483 1.456 . . . . 0.0 115.176 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.449 ' CD ' HD21 ' B' ' 96' ' ' ASN . 6.3 mptt -70.04 -55.28 9.94 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.454 1.479 . . . . 0.0 109.207 168.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.72 -9.61 55.53 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -178.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.2 ttm -56.06 -30.91 62.64 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 120.243 -1.536 . . . . 0.0 112.731 169.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.7 m -66.05 -57.2 13.96 Favored Pre-proline 0 N--CA 1.482 1.153 0 CA-C-O 117.813 -1.089 . . . . 0.0 112.603 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.43 -36.43 79.41 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.916 3.077 . . . . 0.0 114.113 169.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.06 -53.29 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 119.275 0.943 . . . . 0.0 111.196 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.16 75.22 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.235 1.014 . . . . 0.0 111.257 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.491 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.9 t90 -69.37 -53.68 18.29 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 117.649 -1.167 . . . . 0.0 112.22 169.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.491 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.6 t90 -65.09 -32.35 74.02 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.03 -1.468 . . . . 0.0 111.998 -167.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 62.8 ttp -53.63 -46.03 70.36 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.544 1.137 . . . . 0.0 111.893 169.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mm? . . . . . 0 CA--C 1.546 0.793 0 C-N-CA 125.015 1.326 . . . . 0.0 113.841 -178.08 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 . . . . . 0 N--CA 1.469 0.482 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.4 mt -57.07 -26.29 60.15 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.3 m -83.54 -32.41 25.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.918 1.287 . . . . 0.0 112.597 173.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -78.71 -34.51 45.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.775 -1.203 . . . . 0.0 113.447 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.49 -38.26 60.04 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 117.379 -1.296 . . . . 0.0 113.474 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -75.6 -37.55 1.7 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 CA-C-N 122.246 1.838 . . . . 0.0 113.18 168.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -64.02 -33.52 75.93 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.593 -1.317 . . . . 0.0 113.766 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.53 -26.4 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.575 0.75 . . . . 0.0 112.789 178.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 52.3 mt -69.42 -50.1 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.632 0.773 . . . . 0.0 109.323 171.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.4 -42.49 91.9 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.055 0.942 . . . . 0.0 111.878 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.57 -25.7 65.03 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.735 -1.228 . . . . 0.0 112.117 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.54 -45.38 25.58 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.288 -0.883 . . . . 0.0 111.829 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -27.29 68.77 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.459 1.481 . . . . 0.0 113.652 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -71.11 -36.04 72.0 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 168.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -127.51 62.62 55.61 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.234 1.414 . . . . 0.0 110.727 -176.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.83 -13.63 27.8 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.521 2.814 . . . . 0.0 114.786 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -81.69 -23.66 36.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.132 1.773 . . . . 0.0 114.304 -178.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -66.26 156.93 32.86 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.84 1.256 . . . . 0.0 112.072 -175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -89.57 131.78 35.41 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.1 tp -48.17 -52.35 21.11 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -168.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.88 -8.03 40.2 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -174.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 72.6 p -57.59 -27.29 62.59 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 120.539 -1.351 . . . . 0.0 111.118 168.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -71.22 -3.86 22.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.469 1.508 . . . . 0.0 114.48 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -34.55 40.6 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.772 1.169 . . . . 0.0 111.655 167.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.75 -31.41 66.63 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.018 1.327 . . . . 0.0 112.392 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -66.06 -30.31 70.81 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.306 1.442 . . . . 0.0 114.456 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.472 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -167.803 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 . . . . . 0 N--CA 1.444 -0.735 0 N-CA-C 105.12 -2.178 . . . . 0.0 105.12 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 t -104.73 116.1 31.45 Favored 'General case' 0 CA--C 1.505 -0.756 0 O-C-N 120.585 -1.322 . . . . 0.0 112.313 -166.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.14 -32.82 73.36 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.091 167.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.429 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.4 mtmt -63.24 -28.96 70.39 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.504 1.922 . . . . 0.0 114.209 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -113.59 10.44 18.07 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.236 1.414 . . . . 0.0 112.647 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.458 ' HE2' ' HB2' ' B' ' 98' ' ' LYS . 12.7 ttm -64.29 123.43 19.12 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.726 -1.234 . . . . 0.0 108.616 170.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.8 t -79.36 157.85 27.55 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.117 -0.989 . . . . 0.0 110.695 -174.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.53 -35.6 78.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.587 -1.32 . . . . 0.0 112.84 -174.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -61.24 -33.44 73.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -79.9 -38.48 32.47 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.12 1.368 . . . . 0.0 111.67 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -59.19 -49.65 77.04 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.991 0.917 . . . . 0.0 112.705 176.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -67.71 -5.15 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 C-N-CA 124.362 1.065 . . . . 0.0 112.641 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -107.26 -6.83 17.01 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.325 1.45 . . . . 0.0 113.707 173.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.02 160.82 29.44 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.915 -1.115 . . . . 0.0 110.94 175.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 41.9 t-20 -64.78 131.08 95.05 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 121.157 -0.964 . . . . 0.0 111.999 -176.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 29.7 Cg_exo -60.61 -16.53 43.54 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.437 2.758 . . . . 0.0 114.969 -178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -60.27 -67.39 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.717 1.607 . . . . 0.0 110.161 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.12 -3.74 53.02 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 ttt -57.71 -40.46 79.57 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 169.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -64.83 -54.18 37.35 Favored Pre-proline 0 N--CA 1.481 1.125 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -48.97 -44.41 32.52 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.732 2.955 . . . . 0.0 115.886 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.1 p -72.5 -42.25 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.28 -35.69 70.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.877 0.471 . . . . 0.0 110.229 171.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 75.1 t90 -76.3 -49.84 15.9 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.587 177.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.422 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 1.4 t90 -64.75 -25.33 67.88 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 120.383 1.447 . . . . 0.0 111.264 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -66.92 -50.71 61.52 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.422 1.489 . . . . 0.0 111.693 168.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.856 0 C-N-CA 124.543 1.137 . . . . 0.0 113.765 179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.2 t70 . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 119.57 -0.252 . . . . 0.0 110.365 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.0 mt -61.22 -33.61 73.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.892 0.877 . . . . 0.0 112.412 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.2 m -72.9 -35.91 67.19 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.424 1.09 . . . . 0.0 111.404 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm100 -78.52 -24.06 45.94 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.759 -1.115 . . . . 0.0 113.134 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.95 -47.93 95.45 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 120.352 1.433 . . . . 0.0 112.399 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.48 -34.1 21.09 Favored 'Trans proline' 0 C--N 1.354 0.864 0 CA-C-N 121.865 1.702 . . . . 0.0 113.342 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -67.58 -34.33 76.82 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.502 1.501 . . . . 0.0 114.057 -177.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.13 -20.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.77 0.714 . . . . 0.0 112.79 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.83 -50.37 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.501 1.121 . . . . 0.0 110.781 171.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.56 -39.07 79.25 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.9 0.88 . . . . 0.0 111.783 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -69.23 -28.81 66.68 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.434 0.561 . . . . 0.0 111.627 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.7 m -77.68 -46.72 21.1 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.293 -0.88 . . . . 0.0 112.921 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -28.96 67.55 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.85 1.659 . . . . 0.0 114.334 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -75.0 -30.23 61.08 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 173.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -134.13 75.4 65.88 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.098 1.359 . . . . 0.0 112.137 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -59.27 -9.59 8.79 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.405 3.403 . . . . 0.0 117.297 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -81.9 -21.68 37.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.351 1.46 . . . . 0.0 113.129 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -68.76 160.35 30.58 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.809 1.244 . . . . 0.0 111.387 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -83.7 152.04 24.94 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.619 -0.676 . . . . 0.0 110.759 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.9 tp -67.5 -35.4 79.06 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.08 -1.012 . . . . 0.0 113.357 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -90.91 -23.85 20.37 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -58.83 -23.6 60.8 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.366 -0.834 . . . . 0.0 111.675 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -61.46 -4.77 1.41 Allowed 'General case' 0 CA--C 1.539 0.548 0 O-C-N 119.692 -1.88 . . . . 0.0 113.696 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -35.17 67.05 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 120.957 -1.089 . . . . 0.0 111.945 167.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.77 -30.51 71.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.916 0.886 . . . . 0.0 113.249 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.416 ' HG2' ' H ' ' A' ' 72' ' ' GLN . 8.9 pt20 -73.56 -23.14 59.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.729 1.612 . . . . 0.0 114.395 173.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.844 0 C-N-CA 127.0 2.12 . . . . 0.0 116.015 -166.561 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 . . . . . 0 N--CA 1.444 -0.763 0 N-CA-C 103.795 -2.668 . . . . 0.0 103.795 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.2 m -86.44 86.52 7.34 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 125.019 1.328 . . . . 0.0 113.416 -164.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.31 53.53 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.084 1.311 . . . . 0.0 111.033 171.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.409 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 9.4 ptpt -77.67 -0.51 26.96 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.958 2.103 . . . . 0.0 116.411 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -136.45 19.07 3.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.979 1.312 . . . . 0.0 112.233 170.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.4 ttm -60.75 123.22 16.86 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.899 -1.126 . . . . 0.0 108.192 169.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.76 153.87 32.49 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.577 -0.702 . . . . 0.0 109.963 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -61.51 -33.48 73.88 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.805 -1.185 . . . . 0.0 112.991 -173.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -65.94 -30.99 71.66 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.024 0.829 . . . . 0.0 112.975 173.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -77.33 -37.89 51.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.976 1.311 . . . . 0.0 111.101 173.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -62.78 -48.98 76.78 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.446 -0.784 . . . . 0.0 112.702 177.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.6 pt -69.21 -4.11 3.44 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 123.597 0.759 . . . . 0.0 112.977 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.8 -12.62 16.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.145 1.778 . . . . 0.0 114.124 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 159.78 32.87 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 119.763 1.165 . . . . 0.0 110.849 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 51.8 t-20 -66.66 129.09 94.11 Favored Pre-proline 0 N--CA 1.483 1.206 0 O-C-N 121.384 -0.822 . . . . 0.0 111.165 -177.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 31.2 Cg_exo -59.77 -18.17 47.19 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.927 2.418 . . . . 0.0 114.786 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.458 ' HB2' ' HE2' ' A' ' 8' ' ' MET . 32.1 mttp -56.14 -66.76 0.38 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.184 1.793 . . . . 0.0 109.495 168.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.5 -7.22 59.55 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 17.3 ttm -56.82 -43.27 80.86 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.958 -1.089 . . . . 0.0 111.544 169.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 60.3 m -55.61 -57.48 20.88 Favored Pre-proline 0 N--CA 1.484 1.228 0 CA-C-O 118.036 -0.983 . . . . 0.0 113.551 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -52.93 -43.39 57.06 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.21 3.273 . . . . 0.0 115.621 172.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.2 p -73.92 -39.24 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 120.235 1.38 . . . . 0.0 113.263 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.29 -29.89 69.12 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.086 0.954 . . . . 0.0 111.061 172.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.51 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 61.1 t90 -79.37 -53.49 6.87 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.353 169.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.51 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.5 t90 -64.55 -29.9 70.93 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 120.903 1.683 . . . . 0.0 112.65 -167.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -61.36 -51.28 69.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.355 1.062 . . . . 0.0 111.415 171.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.685 0 C-N-CA 125.671 1.588 . . . . 0.0 111.666 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.7 mt -54.27 -36.75 63.96 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 33.9 m -77.38 -35.03 54.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.166 0.586 . . . . 0.0 111.852 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -79.44 -23.61 43.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 117.57 -1.205 . . . . 0.0 114.071 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mm -53.09 -47.21 96.61 Favored Pre-proline 0 N--CA 1.483 1.182 0 CA-C-N 120.757 1.617 . . . . 0.0 112.406 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.53 -32.0 12.8 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.663 1.575 . . . . 0.0 113.759 172.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.47 -35.68 80.87 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.877 -1.139 . . . . 0.0 113.171 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.8 m -69.33 -26.39 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.476 0.58 . . . . 0.0 112.341 174.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.08 -51.1 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.334 0.654 . . . . 0.0 110.334 172.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -52.49 -47.86 66.29 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.841 0.856 . . . . 0.0 112.075 173.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -69.5 -23.37 63.61 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.175 -0.953 . . . . 0.0 112.311 -175.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -78.43 -48.23 15.87 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.277 -0.89 . . . . 0.0 112.049 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -27.25 69.04 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.929 1.241 . . . . 0.0 113.646 174.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -70.94 -33.54 70.6 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -128.22 63.19 62.0 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.171 1.388 . . . . 0.0 111.029 -176.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.2 -14.77 20.78 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.142 3.228 . . . . 0.0 116.608 -169.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -89.41 -18.23 27.22 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 -178.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -66.45 158.96 28.16 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.573 1.149 . . . . 0.0 112.033 -176.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.02 130.75 34.88 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 62.2 tp -46.14 -37.03 6.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 114.027 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.409 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.5 m-85 -78.76 -9.78 59.55 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.7 p -64.77 -24.28 67.51 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 120.603 -1.311 . . . . 0.0 111.671 168.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -73.41 -3.72 29.13 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -78.89 -35.03 44.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.922 1.289 . . . . 0.0 111.558 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -68.34 -32.17 72.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.6 1.16 . . . . 0.0 112.39 -169.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -70.12 -29.24 66.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 115.007 173.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.866 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.402 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 28.2 mm-40 . . . . . 0 N--CA 1.471 0.589 0 CA-C-O 117.855 -1.069 . . . . 0.0 112.654 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.5 m 99.24 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 129.645 3.178 . . . . 0.0 115.768 167.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.15 -35.92 72.23 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.997 -1.689 . . . . 0.0 112.339 175.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.463 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -73.13 1.59 8.86 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 173.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -126.22 6.6 7.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.118 1.367 . . . . 0.0 112.126 168.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.45 ' HE2' ' HB2' ' B' ' 98' ' ' LYS . 35.2 ttm -61.61 126.92 29.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.752 -1.217 . . . . 0.0 109.725 172.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.4 t -78.53 154.14 30.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.0 -33.08 74.65 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.8 -1.188 . . . . 0.0 113.132 -174.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -61.88 -32.15 72.49 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -78.62 -38.26 40.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.635 1.174 . . . . 0.0 111.605 175.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -58.13 -50.32 73.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.1 pt -67.5 -7.96 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.48 1.112 . . . . 0.0 113.178 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -105.0 -8.58 18.45 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 125.812 1.645 . . . . 0.0 113.615 175.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.34 159.4 33.4 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 121.065 -1.022 . . . . 0.0 110.738 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -75.93 137.29 69.52 Favored Pre-proline 0 N--CA 1.483 1.199 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -168.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.56 -14.27 41.55 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.159 2.573 . . . . 0.0 116.486 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -63.31 -61.3 2.44 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 125.449 1.5 . . . . 0.0 108.589 166.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.496 ' HB1' HG21 ' B' ' 103' ' ' VAL . . . -81.93 -10.19 59.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.8 ttt -58.63 -35.08 71.92 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.4 m -64.73 -54.56 35.03 Favored Pre-proline 0 N--CA 1.483 1.182 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -176.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.419 ' HG2' HG22 ' B' ' 103' ' ' VAL . 16.4 Cg_endo -54.71 -36.85 91.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.902 2.401 . . . . 0.0 115.739 173.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -38.45 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 119.492 1.042 . . . . 0.0 113.549 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -26.41 67.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.876 0.87 . . . . 0.0 111.151 173.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.517 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 70.7 t90 -87.28 -52.4 5.42 Favored 'General case' 0 C--N 1.343 0.304 0 CA-C-O 117.443 -1.265 . . . . 0.0 112.887 169.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.517 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.5 t90 -67.64 -24.72 65.48 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 121.297 1.862 . . . . 0.0 112.25 -167.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -63.85 -50.16 69.97 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.215 1.006 . . . . 0.0 111.349 169.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.545 0.786 0 C-N-CA 125.216 1.406 . . . . 0.0 111.852 -176.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 54.7 mt -66.04 -28.99 69.27 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.551 -0.718 . . . . 0.0 112.025 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.1 m -74.73 -38.53 62.25 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.795 0.838 . . . . 0.0 111.373 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -79.39 -31.16 42.73 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 117.53 -1.224 . . . . 0.0 113.555 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.5 mp -51.23 -42.16 79.47 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 120.79 1.632 . . . . 0.0 113.305 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -71.76 -38.37 4.3 Favored 'Trans proline' 0 C--N 1.352 0.763 0 CA-C-N 122.138 1.799 . . . . 0.0 113.574 169.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mmtt -67.19 -33.41 75.33 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.084 -1.635 . . . . 0.0 113.801 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.3 m -68.2 -18.5 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.1 mt -87.68 -50.44 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.632 1.173 . . . . 0.0 110.268 172.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -58.56 -36.83 74.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.091 0.957 . . . . 0.0 111.934 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -70.85 -28.72 64.8 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.604 0.638 . . . . 0.0 111.882 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -77.11 -41.52 41.73 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.982 -1.073 . . . . 0.0 112.658 176.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -29.2 67.5 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 120.71 1.595 . . . . 0.0 113.973 177.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.416 ' HG3' HD22 ' A' ' 61' ' ' ASN . 14.0 ptpt -81.48 -27.5 34.54 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.416 HD22 ' HG3' ' A' ' 60' ' ' LYS . 17.8 m-80 -130.8 70.84 82.58 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.625 1.57 . . . . 0.0 110.754 173.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.92 -11.99 13.85 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 124.858 3.705 . . . . 0.0 116.368 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -84.63 -21.45 30.28 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.359 1.464 . . . . 0.0 113.292 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -67.9 156.34 37.41 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.669 0.787 . . . . 0.0 111.996 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -89.06 131.72 35.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.4 -38.42 28.85 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -169.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.26 5.4 m-85 -78.46 -8.3 58.37 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.369 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.7 p -61.01 -23.54 65.48 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.416 -1.427 . . . . 0.0 111.633 167.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.82 -10.72 59.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.699 -1.25 . . . . 0.0 112.568 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -31.78 71.44 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.725 1.148 . . . . 0.0 111.185 168.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.42 -13.44 62.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.642 1.177 . . . . 0.0 112.312 -173.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -82.87 -29.85 29.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.398 2.279 . . . . 0.0 114.689 173.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -164.029 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 . . . . . 0 N--CA 1.473 0.701 0 CA-C-O 118.873 -0.584 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.2 t 94.44 104.52 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.407 3.083 . . . . 0.0 116.231 168.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.64 74.89 Favored 'General case' 0 CA--C 1.551 0.996 0 O-C-N 120.711 -1.243 . . . . 0.0 111.191 169.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.465 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 23.4 mtmt -62.61 -28.03 69.61 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.416 1.486 . . . . 0.0 114.178 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -105.91 8.23 32.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.634 1.173 . . . . 0.0 113.478 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 49.2 ttm -63.91 130.34 43.69 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.644 -1.285 . . . . 0.0 110.392 173.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.2 t -79.32 156.28 28.1 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.01 -1.056 . . . . 0.0 110.814 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.25 -32.67 71.37 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.079 -1.638 . . . . 0.0 112.884 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -63.3 -32.13 73.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -74.96 -40.4 60.78 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.646 0.779 . . . . 0.0 111.938 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -60.34 -46.02 91.41 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.221 0.464 . . . . 0.0 111.892 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -72.21 -10.44 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.614 175.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.45 -20.25 20.48 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 170.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 156.0 37.15 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.029 0.932 . . . . 0.0 112.285 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.436 HD21 ' HD2' ' B' ' 98' ' ' LYS . 1.1 t-20 -56.11 135.45 74.44 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.631 1.172 . . . . 0.0 113.203 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 13.6 Cg_exo -75.39 -5.87 17.12 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.419 1.413 . . . . 0.0 115.474 -178.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.45 ' HB2' ' HE2' ' A' ' 8' ' ' MET . 12.8 mttt -70.68 -59.74 2.65 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.48 1.491 . . . . 0.0 109.509 167.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . 0.437 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -81.55 -11.38 59.18 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -177.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 23.8 ttm -53.98 -31.09 49.66 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.611 -1.306 . . . . 0.0 112.92 171.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 36.3 m -68.44 -57.36 8.73 Favored Pre-proline 0 N--CA 1.484 1.254 0 CA-C-O 117.998 -1.001 . . . . 0.0 112.751 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.03 -36.27 75.43 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.83 3.02 . . . . 0.0 114.096 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.496 HG21 ' HB1' ' A' ' 20' ' ' ALA . 60.7 t -64.12 -52.17 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 121.469 -0.769 . . . . 0.0 111.395 175.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.42 -36.36 80.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.636 1.175 . . . . 0.0 111.372 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.513 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.7 t90 -71.31 -51.12 26.12 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 117.054 -1.45 . . . . 0.0 113.088 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.447 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.91 -27.68 67.69 Favored 'General case' 0 C--N 1.349 0.582 0 C-N-CA 116.911 -1.916 . . . . 0.0 111.139 -169.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.6 tmm? -60.59 -42.1 96.05 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.082 0.953 . . . . 0.0 112.217 169.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.046 1.338 . . . . 0.0 114.395 177.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 . . . . . 0 N--CA 1.469 0.515 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.47 -29.96 62.35 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 42.5 m -81.07 -36.39 30.53 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.092 0.957 . . . . 0.0 112.187 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -80.24 -30.06 38.48 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.055 -1.028 . . . . 0.0 113.723 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.84 -41.4 84.53 Favored Pre-proline 0 CA--C 1.552 1.052 0 CA-C-N 120.351 1.432 . . . . 0.0 113.629 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -73.29 -37.32 3.39 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 CA-C-N 122.477 1.92 . . . . 0.0 113.468 169.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -67.65 -28.84 68.05 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 120.338 -1.477 . . . . 0.0 114.232 -175.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.25 -26.72 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 118.59 0.632 . . . . 0.0 112.076 173.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 43.6 mt -70.24 -51.27 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 123.927 0.891 . . . . 0.0 109.438 171.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -53.21 -48.85 67.8 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.79 0.836 . . . . 0.0 112.033 173.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -70.09 -25.1 63.36 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.124 -0.985 . . . . 0.0 112.075 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.34 -46.2 28.65 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.635 0.774 . . . . 0.0 112.177 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -26.69 67.36 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 120.389 1.45 . . . . 0.0 113.622 173.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttm -70.28 -31.58 69.0 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 168.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -133.18 65.25 72.77 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 125.046 1.338 . . . . 0.0 112.381 -179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -58.82 -15.29 25.93 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.094 2.529 . . . . 0.0 116.732 -171.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -83.7 -16.42 45.0 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.922 1.289 . . . . 0.0 113.603 -177.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -72.87 153.8 40.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.953 0.901 . . . . 0.0 111.375 -172.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -85.62 132.82 34.1 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.5 tp -51.52 -36.16 43.68 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 6.1 m-85 -81.76 -6.47 59.08 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.3 p -61.19 -27.55 68.5 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 120.524 -1.36 . . . . 0.0 111.317 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.37 -4.02 23.95 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.472 1.509 . . . . 0.0 114.317 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -29.46 37.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.97 1.308 . . . . 0.0 112.021 167.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.26 -32.31 64.62 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.646 1.178 . . . . 0.0 112.2 -171.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.36 -28.6 67.26 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.697 1.599 . . . . 0.0 114.864 173.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -166.965 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 . . . . . 0 N--CA 1.443 -0.789 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.8 t -102.57 103.44 13.77 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.367 1.467 . . . . 0.0 113.091 -164.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.99 70.52 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.434 -1.416 . . . . 0.0 110.748 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.471 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.0 ptpt -74.1 -4.69 37.14 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -125.83 12.29 7.87 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.151 1.381 . . . . 0.0 112.139 168.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.0 ttm -60.6 122.44 14.72 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.623 -1.298 . . . . 0.0 108.544 170.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.9 t -75.96 154.64 35.72 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.867 -1.146 . . . . 0.0 110.421 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.66 -30.94 71.97 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.267 -1.521 . . . . 0.0 113.342 -172.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -40.72 97.52 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.017 0.826 . . . . 0.0 111.928 170.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.69 -37.36 82.2 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.199 1.0 . . . . 0.0 111.568 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.65 -51.86 67.62 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.563 0.745 . . . . 0.0 112.353 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -69.43 -1.77 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 124.554 1.142 . . . . 0.0 112.737 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -106.59 -7.58 17.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.483 1.513 . . . . 0.0 113.587 171.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.14 160.71 29.48 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.021 -1.049 . . . . 0.0 111.135 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.444 HD21 ' HD3' ' A' ' 19' ' ' LYS . 46.2 t-20 -66.0 128.76 94.04 Favored Pre-proline 0 N--CA 1.484 1.273 0 O-C-N 121.024 -1.047 . . . . 0.0 111.528 -175.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.6 -21.02 23.11 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 124.094 3.196 . . . . 0.0 115.607 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.8 mptt -57.89 -68.07 0.28 Allowed 'General case' 0 C--N 1.351 0.639 0 C-N-CA 126.117 1.767 . . . . 0.0 109.539 168.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.423 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -78.17 -7.9 57.64 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 10.9 ttt -62.84 -35.86 81.33 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.291 -1.505 . . . . 0.0 113.206 170.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.4 m -60.43 -53.66 62.53 Favored Pre-proline 0 N--CA 1.485 1.311 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.409 ' HA ' ' CE2' ' B' ' 106' ' ' TRP . 2.7 Cg_endo -49.31 -47.12 23.38 Favored 'Trans proline' 0 CA--C 1.51 -0.694 0 C-N-CA 123.389 2.726 . . . . 0.0 114.133 167.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 20' ' ' ALA . 57.2 t -57.88 -32.94 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.807 0.443 . . . . 0.0 111.793 -178.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.96 -27.42 65.71 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.385 1.074 . . . . 0.0 113.579 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.415 ' CB ' ' CH2' ' B' ' 106' ' ' TRP . 52.4 t90 -88.14 -39.38 14.58 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.81 1.186 . . . . 0.0 109.993 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.537 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 3.6 m95 -62.76 -35.08 78.67 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -167.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -72.85 -47.61 44.65 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.257 1.423 . . . . 0.0 112.787 168.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 CA--C 1.543 0.697 0 C-N-CA 124.829 1.251 . . . . 0.0 114.12 -168.81 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 . . . . . 0 N--CA 1.466 0.352 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.49 -25.15 68.13 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.141 -0.975 . . . . 0.0 112.439 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.0 m -78.54 -37.98 41.56 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.592 0.757 . . . . 0.0 111.467 171.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -81.7 -30.85 32.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.974 -1.012 . . . . 0.0 113.148 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.04 -41.68 75.56 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-O 117.232 -1.366 . . . . 0.0 113.008 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.95 -37.85 2.59 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 122.336 1.87 . . . . 0.0 113.807 168.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -67.82 -33.41 74.74 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.032 -1.667 . . . . 0.0 113.633 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 19.1 m -68.32 -13.95 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.4 mt -92.09 -51.09 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.635 1.174 . . . . 0.0 110.578 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.89 -35.52 73.15 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.974 0.909 . . . . 0.0 111.771 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -68.53 -29.62 68.24 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 122.078 -0.389 . . . . 0.0 111.915 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.27 -45.7 31.44 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.838 -1.164 . . . . 0.0 112.745 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.54 68.79 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.644 1.566 . . . . 0.0 113.977 177.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -77.06 -32.82 57.14 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -133.2 77.22 67.4 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 124.639 1.176 . . . . 0.0 112.094 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.55 -9.96 3.13 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 124.772 3.648 . . . . 0.0 117.024 175.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.39 -25.57 51.0 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.045 1.338 . . . . 0.0 112.511 -177.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -67.13 153.59 43.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.926 1.291 . . . . 0.0 111.448 -172.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -87.38 131.61 34.23 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 169.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -51.72 -36.72 47.99 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -169.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.471 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.0 m-85 -79.57 -6.85 57.9 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 58.8 p -59.79 -26.7 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.458 -1.401 . . . . 0.0 111.053 167.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -71.84 -3.1 20.35 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.754 1.622 . . . . 0.0 114.143 177.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -31.65 25.5 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.976 1.31 . . . . 0.0 111.693 169.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.3 -26.19 64.61 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.27 1.028 . . . . 0.0 112.151 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -74.85 -29.51 61.07 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.563 1.545 . . . . 0.0 114.929 171.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 125.04 1.336 . . . . 0.0 114.604 -166.61 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 15.6 t -93.94 97.56 10.44 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -166.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.74 -33.25 64.11 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 120.944 -1.098 . . . . 0.0 111.091 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -64.41 -31.33 72.49 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.537 1.935 . . . . 0.0 114.608 177.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -114.26 13.9 17.98 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.925 1.29 . . . . 0.0 113.132 -177.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.0 ttm -58.77 122.31 13.25 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.919 -1.113 . . . . 0.0 108.888 169.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.6 t -77.46 156.84 30.81 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.876 -1.14 . . . . 0.0 110.682 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.04 -34.06 76.76 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.142 -1.598 . . . . 0.0 112.909 -173.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -65.1 -31.45 72.66 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.192 0.906 . . . . 0.0 112.595 173.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -77.63 -37.08 50.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.784 1.234 . . . . 0.0 111.35 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -62.51 -49.42 75.44 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.331 -0.856 . . . . 0.0 112.28 176.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.05 -7.61 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.683 0.793 . . . . 0.0 112.971 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -100.88 -13.91 18.16 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.936 1.694 . . . . 0.0 113.877 171.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.34 158.42 35.11 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.454 1.025 . . . . 0.0 111.114 173.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -62.33 133.91 94.62 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.894 0.878 . . . . 0.0 112.815 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.43 -13.88 33.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.789 2.326 . . . . 0.0 116.042 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -66.38 -50.41 63.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 121.151 1.796 . . . . 0.0 107.929 168.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -87.98 -5.18 58.66 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 25.0 mtt -55.46 -44.48 76.44 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.652 -1.28 . . . . 0.0 111.98 169.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 89.4 m -61.17 -52.62 70.16 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 124.666 1.186 . . . . 0.0 113.088 -175.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . 0.428 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 11.6 Cg_endo -52.97 -49.75 16.48 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 124.047 3.165 . . . . 0.0 114.983 171.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.06 -37.05 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.672 -1.268 . . . . 0.0 112.867 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.38 -29.8 70.74 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.593 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.537 ' CD2' ' CZ2' ' A' ' 27' ' ' TRP . 73.2 t90 -81.81 -46.42 14.2 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.191 1.359 . . . . 0.0 112.452 173.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.415 ' CH2' ' CB ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -41.02 -38.55 1.01 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.703 0.801 . . . . 0.0 111.962 169.485 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 57.5 ttp -75.08 -64.58 1.02 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.409 1.484 . . . . 0.0 113.849 169.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.476 0.868 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 . . . . . 0 N--CA 1.466 0.36 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.2 mt -54.57 -33.67 60.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.145 0.978 . . . . 0.0 112.881 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 51.9 m -77.51 -35.2 53.74 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.664 0.786 . . . . 0.0 111.92 175.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -81.22 -23.46 38.09 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.94 -47.05 96.87 Favored Pre-proline 0 N--CA 1.482 1.126 0 CA-C-N 120.305 1.411 . . . . 0.0 112.338 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.3 -34.95 14.98 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 122.065 1.773 . . . . 0.0 113.612 172.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -66.0 -32.06 73.33 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.625 -1.297 . . . . 0.0 113.539 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.91 -28.31 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 61.5 mt -69.55 -49.53 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.883 0.873 . . . . 0.0 109.8 172.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.39 -53.52 56.41 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.712 0.805 . . . . 0.0 111.208 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -62.56 -26.41 68.56 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.073 -1.017 . . . . 0.0 113.068 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.75 -48.01 17.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.187 0.903 . . . . 0.0 112.561 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -25.2 67.1 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 121.059 1.754 . . . . 0.0 113.653 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -73.45 -28.02 61.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.725 1.61 . . . . 0.0 114.478 168.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -135.01 63.65 58.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.122 1.369 . . . . 0.0 110.735 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -63.82 -12.42 31.6 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.403 2.735 . . . . 0.0 115.871 -168.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.16 -17.01 38.5 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.348 1.459 . . . . 0.0 113.447 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -74.32 161.38 29.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.536 1.135 . . . . 0.0 111.985 -173.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -75.02 159.99 31.08 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.68 -0.638 . . . . 0.0 109.772 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.9 tp -70.8 -62.91 1.22 Allowed 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.586 -0.696 . . . . 0.0 112.257 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -61.52 -24.0 66.31 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 -167.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.7 t -57.46 -23.68 51.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.742 -0.599 . . . . 0.0 112.066 172.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -63.85 -3.46 2.46 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 119.789 -1.819 . . . . 0.0 114.5 174.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -35.38 63.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.235 1.379 . . . . 0.0 111.396 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -33.56 75.89 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -167.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -67.53 -27.22 66.79 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.541 1.937 . . . . 0.0 115.053 172.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.581 0 C-N-CA 125.102 1.361 . . . . 0.0 113.845 -167.787 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.404 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 23.3 mm-40 . . . . . 0 N--CA 1.469 0.49 0 CA-C-O 118.939 -0.553 . . . . 0.0 111.475 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t 97.78 106.52 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 129.647 3.179 . . . . 0.0 114.682 168.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.49 -31.0 70.97 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.708 -1.245 . . . . 0.0 111.347 170.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.449 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 9.1 mtmt -63.65 -25.08 68.05 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.449 1.5 . . . . 0.0 114.366 175.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.09 5.85 28.33 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.829 1.252 . . . . 0.0 113.356 175.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 41.4 ttm -62.03 125.31 23.43 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.656 -1.277 . . . . 0.0 109.922 173.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -78.57 155.92 29.42 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.842 -1.161 . . . . 0.0 110.187 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.63 -35.71 78.66 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.588 -1.32 . . . . 0.0 112.84 -174.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -61.69 -35.03 76.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 172.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -77.09 -37.38 54.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.653 1.181 . . . . 0.0 111.342 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -60.49 -49.91 75.65 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.619 -0.675 . . . . 0.0 112.378 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.5 pt -69.49 -1.68 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 124.394 1.078 . . . . 0.0 112.663 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -110.0 -12.27 14.55 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.522 1.529 . . . . 0.0 113.897 174.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.25 163.08 25.81 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 121.02 -1.05 . . . . 0.0 110.5 169.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.481 HD21 ' HD3' ' A' ' 19' ' ' LYS . 47.4 t-20 -66.1 131.18 94.42 Favored Pre-proline 0 N--CA 1.483 1.192 0 O-C-N 120.745 -1.222 . . . . 0.0 112.05 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 30.6 Cg_exo -61.39 -16.3 46.37 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.459 2.772 . . . . 0.0 115.415 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HD3' HD21 ' A' ' 17' ' ' ASN . 5.1 mptt -56.93 -61.74 2.23 Favored 'General case' 0 C--N 1.35 0.61 0 C-N-CA 125.983 1.713 . . . . 0.0 108.814 168.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.452 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -82.44 -7.74 59.63 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 86.5 mtp -58.86 -37.0 75.52 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 120.403 1.456 . . . . 0.0 112.859 171.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.9 m -62.04 -55.96 36.06 Favored Pre-proline 0 N--CA 1.486 1.344 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -56.21 -39.05 93.72 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.265 2.643 . . . . 0.0 112.885 169.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 20' ' ' ALA . 99.1 t -60.39 -42.84 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 120.033 -1.667 . . . . 0.0 111.969 175.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.34 -41.98 79.97 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.082 0.953 . . . . 0.0 110.962 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HB3' ' CH2' ' B' ' 106' ' ' TRP 0.267 0.0 OUTLIER -73.34 -41.58 63.3 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 115.974 -1.965 . . . . 0.0 111.404 177.029 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.484 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 0.3 OUTLIER -65.58 -25.22 67.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.644 2.474 . . . . 0.0 113.85 175.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -67.04 -45.52 77.17 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.808 -0.557 . . . . 0.0 111.144 168.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 113.734 -177.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 . . . . . 0 N--CA 1.468 0.428 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 68.3 mt -64.57 -19.24 65.53 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.143 0.977 . . . . 0.0 112.954 175.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.5 m -89.15 -27.63 20.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.529 1.932 . . . . 0.0 112.323 173.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -83.45 -33.98 25.54 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 120.814 -1.178 . . . . 0.0 111.823 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.52 -42.76 89.76 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-O 117.227 -1.368 . . . . 0.0 113.535 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.13 -39.77 7.25 Favored 'Trans proline' 0 C--N 1.35 0.654 0 CA-C-N 122.571 1.954 . . . . 0.0 112.845 169.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -62.94 -38.81 92.53 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.625 1.557 . . . . 0.0 113.461 -176.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.0 m -70.41 -19.54 22.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.372 0.669 . . . . 0.0 112.491 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.8 mt -81.36 -47.99 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.316 -0.865 . . . . 0.0 109.933 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.84 -37.22 78.64 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.101 0.96 . . . . 0.0 112.008 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -68.62 -26.23 65.25 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.695 0.679 . . . . 0.0 111.758 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.0 m -77.65 -46.74 21.11 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.234 -0.916 . . . . 0.0 112.89 174.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -29.17 67.95 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 120.799 1.636 . . . . 0.0 114.166 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.66 -27.76 55.72 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -135.16 74.31 62.59 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.996 1.318 . . . . 0.0 112.073 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -59.03 -9.66 8.39 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 124.36 3.373 . . . . 0.0 117.371 -177.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -82.21 -22.11 36.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.981 1.312 . . . . 0.0 113.139 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? -68.9 157.7 36.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.3 1.04 . . . . 0.0 111.7 -174.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -75.86 152.39 37.21 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 169.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.5 -39.92 81.1 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.015 -1.053 . . . . 0.0 113.087 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.449 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.2 m-85 -86.68 -19.28 29.46 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -58.97 -23.46 61.7 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.318 -0.864 . . . . 0.0 111.671 170.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -58.19 -15.81 11.27 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.761 -1.837 . . . . 0.0 112.902 171.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.3 tptt -58.58 -35.28 72.15 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.045 -1.034 . . . . 0.0 112.597 168.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.16 -26.03 67.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.714 0.806 . . . . 0.0 112.208 -169.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -68.48 -30.21 69.0 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.894 2.078 . . . . 0.0 114.233 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.784 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -165.194 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 106.201 -1.777 . . . . 0.0 106.201 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.2 t -97.84 98.36 9.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 120.948 -1.095 . . . . 0.0 113.89 -166.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.52 62.79 Favored 'General case' 0 CA--C 1.555 1.164 0 O-C-N 120.771 -1.205 . . . . 0.0 110.815 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt -59.7 -30.78 69.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.988 2.115 . . . . 0.0 115.03 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -117.52 12.69 14.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.837 1.255 . . . . 0.0 113.107 -175.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 54.4 ttm -60.88 119.7 8.74 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.002 -1.061 . . . . 0.0 108.949 169.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -75.95 156.42 34.19 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.115 -0.99 . . . . 0.0 110.422 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -33.19 73.86 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.486 -1.384 . . . . 0.0 112.957 -172.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -65.75 -32.87 74.66 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.153 0.888 . . . . 0.0 112.865 173.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -77.41 -35.6 54.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.274 1.43 . . . . 0.0 111.17 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.51 -51.36 65.83 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.307 1.043 . . . . 0.0 112.411 175.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.9 pt -68.01 -4.03 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -103.01 -11.25 18.3 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.088 1.755 . . . . 0.0 114.182 170.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.17 157.61 37.31 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.983 1.265 . . . . 0.0 110.748 171.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.413 HD21 ' HD3' ' B' ' 98' ' ' LYS 0.262 0.1 OUTLIER -73.37 146.51 86.61 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -169.66 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -71.84 -10.55 26.51 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.865 1.71 . . . . 0.0 114.717 -177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.413 ' HD3' HD21 ' B' ' 96' ' ' ASN . 5.8 mptt -67.81 -55.44 12.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.876 1.216 . . . . 0.0 108.572 167.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.65 -13.96 52.98 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.9 mmt -47.69 -43.43 26.55 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.742 1.156 . . . . 0.0 112.581 171.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -61.3 -55.31 44.77 Favored Pre-proline 0 N--CA 1.481 1.111 0 C-N-CA 124.535 1.134 . . . . 0.0 113.606 -171.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . 0.402 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 14.0 Cg_endo -54.7 -47.4 26.92 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.471 2.781 . . . . 0.0 114.513 171.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.7 p -70.17 -34.54 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 120.574 -1.329 . . . . 0.0 113.095 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.61 -25.21 67.28 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.671 0.788 . . . . 0.0 111.746 173.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.484 ' CG ' ' CZ2' ' A' ' 27' ' ' TRP . 62.6 t90 -80.78 -50.27 10.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.436 1.017 . . . . 0.0 111.254 168.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CH2' ' HB3' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -50.45 -44.37 55.47 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 121.696 0.76 . . . . 0.0 112.258 -172.724 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -64.47 -45.36 87.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.317 1.047 . . . . 0.0 112.045 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.545 0.785 0 C-N-CA 125.072 1.349 . . . . 0.0 113.012 -171.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.47 0.566 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -32.64 67.51 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 59.3 m -78.57 -36.04 45.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.701 0.8 . . . . 0.0 111.796 175.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -81.42 -32.96 32.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 117.428 -1.273 . . . . 0.0 114.421 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -48.11 -47.92 64.75 Favored Pre-proline 0 N--CA 1.482 1.157 0 CA-C-N 120.667 1.576 . . . . 0.0 113.175 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.92 -32.26 29.29 Favored 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 122.116 1.791 . . . . 0.0 113.811 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -65.2 -30.78 71.71 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.584 -1.322 . . . . 0.0 113.456 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.55 -31.76 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.285 0.493 . . . . 0.0 111.267 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -71.84 -50.77 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.564 1.146 . . . . 0.0 109.847 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.85 -39.96 82.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.414 0.686 . . . . 0.0 112.453 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -71.43 -27.44 63.29 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 118.828 0.74 . . . . 0.0 112.725 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -73.84 -47.99 34.44 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.403 -0.811 . . . . 0.0 112.478 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -26.79 67.82 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 120.359 1.436 . . . . 0.0 114.832 -178.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -80.67 -16.93 52.75 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -137.78 65.34 45.91 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 125.425 1.49 . . . . 0.0 111.463 174.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -64.12 -11.59 28.33 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.856 3.037 . . . . 0.0 115.923 -169.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -83.99 -17.1 41.62 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.014 1.325 . . . . 0.0 113.328 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -74.01 158.95 33.39 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.615 1.166 . . . . 0.0 111.545 -174.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.63 154.05 27.61 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.674 -0.641 . . . . 0.0 110.094 172.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -66.3 -44.9 82.18 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.24 -0.913 . . . . 0.0 113.044 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -77.55 -19.77 55.19 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -169.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 12.6 t -64.45 -16.4 62.36 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.738 -1.226 . . . . 0.0 112.412 169.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -67.56 -2.97 7.47 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.348 -2.095 . . . . 0.0 113.499 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -27.95 35.71 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.28 1.432 . . . . 0.0 112.293 167.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -64.36 -35.44 80.89 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.899 1.28 . . . . 0.0 112.049 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -72.1 -28.35 63.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.445 1.898 . . . . 0.0 115.403 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.79 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -166.673 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 N--CA 1.443 -0.805 0 N-CA-C 103.614 -2.735 . . . . 0.0 103.614 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 m -94.9 87.72 5.06 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 125.331 1.452 . . . . 0.0 112.458 -163.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.29 -34.55 70.66 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 121.026 1.739 . . . . 0.0 110.706 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -20.52 62.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.72 2.408 . . . . 0.0 113.969 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -125.16 18.35 8.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.338 1.455 . . . . 0.0 112.145 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.7 ttm -60.62 119.67 8.55 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 169.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.68 154.8 36.29 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.069 -1.02 . . . . 0.0 109.458 -178.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.4 -34.62 75.66 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.466 -1.396 . . . . 0.0 112.951 -173.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -63.06 -34.62 77.98 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 172.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -76.14 -37.84 57.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.225 1.41 . . . . 0.0 111.253 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -62.14 -48.69 78.98 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.207 -0.933 . . . . 0.0 112.343 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.0 pt -70.35 -2.22 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 C-N-CA 123.671 0.788 . . . . 0.0 112.672 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -107.62 -15.33 14.61 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.86 1.664 . . . . 0.0 113.684 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.24 159.13 24.42 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.02 -1.05 . . . . 0.0 110.261 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.606 HD21 ' HD3' ' A' ' 19' ' ' LYS . 47.9 t-20 -67.01 128.09 93.75 Favored Pre-proline 0 N--CA 1.478 0.961 0 O-C-N 121.269 -0.894 . . . . 0.0 109.346 177.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -65.68 -20.72 59.47 Favored 'Trans proline' 0 N--CA 1.444 -1.397 0 C-N-CA 122.48 2.12 . . . . 0.0 111.636 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.8 mptt -48.79 -52.44 23.93 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 120.273 1.397 . . . . 0.0 108.697 169.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.66 0.04 40.45 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 31.6 mtt -65.89 -49.71 67.09 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 120.121 1.328 . . . . 0.0 112.199 173.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.25 -54.69 11.22 Favored Pre-proline 0 N--CA 1.49 1.564 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -176.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -60.05 -42.38 44.46 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.324 2.016 . . . . 0.0 113.725 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.402 HG22 ' HG2' ' B' ' 102' ' ' PRO . 12.0 t -63.2 -45.82 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.336 0.971 . . . . 0.0 111.023 177.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.61 91.13 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.71 1.204 . . . . 0.0 111.109 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 73.8 t90 -68.87 -52.99 23.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 117.794 -1.098 . . . . 0.0 112.651 170.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.425 ' CH2' ' HB3' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -51.57 -41.73 61.37 Favored 'General case' 0 C--N 1.347 0.486 0 CA-C-O 122.428 1.109 . . . . 0.0 111.491 -174.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -66.18 -44.29 84.42 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.488 1.515 . . . . 0.0 112.143 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.468 0.459 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.5 p30 . . . . . 0 N--CA 1.469 0.475 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.97 -27.69 68.34 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.773 1.169 . . . . 0.0 111.963 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.0 m -74.55 -36.99 63.12 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.701 0.4 . . . . 0.0 110.33 169.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -84.09 -27.24 28.38 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -174.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.94 -41.02 77.1 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 121.212 1.824 . . . . 0.0 112.489 176.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.48 -38.0 2.82 Favored 'Trans proline' 0 C--N 1.353 0.777 0 CA-C-N 122.301 1.858 . . . . 0.0 113.432 168.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -66.95 -30.68 70.88 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.509 -1.37 . . . . 0.0 113.802 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.9 m -70.47 -20.98 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.097 0.862 . . . . 0.0 112.556 173.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 mt -81.78 -50.73 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 O-C-N 121.48 -0.763 . . . . 0.0 110.242 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.38 -41.81 85.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.835 0.854 . . . . 0.0 111.747 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -70.89 -22.75 62.24 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.994 -1.066 . . . . 0.0 111.725 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.5 m -79.44 -45.25 19.8 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.498 172.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -27.49 68.89 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.825 1.648 . . . . 0.0 113.761 173.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -69.15 -38.15 78.63 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 168.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -128.74 68.44 78.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.791 1.236 . . . . 0.0 112.143 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -55.59 -15.8 13.09 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.471 2.781 . . . . 0.0 115.883 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -80.14 -25.05 40.03 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.918 1.687 . . . . 0.0 113.268 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -75.55 162.89 27.9 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.07 1.348 . . . . 0.0 112.186 -170.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -77.34 150.6 35.17 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.584 -0.697 . . . . 0.0 109.175 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.7 tp -67.28 -33.85 76.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -88.78 -22.59 23.2 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -169.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.7 t -59.74 -21.09 60.23 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.508 -0.745 . . . . 0.0 111.842 169.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -58.57 -14.62 8.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 119.529 -1.982 . . . . 0.0 113.747 171.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -34.33 72.7 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.101 1.319 . . . . 0.0 111.845 166.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -25.51 66.57 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.663 0.744 . . . . 0.0 112.447 -170.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -66.65 -33.85 76.57 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.602 1.961 . . . . 0.0 113.938 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -165.458 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.272 9.6 mt-10 . . . . . 0 CA--C 1.558 1.276 0 CA-C-O 121.913 0.863 . . . . 0.0 109.041 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . 0.58 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 37.1 t -129.33 113.18 14.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.982 1.713 . . . . 0.0 113.804 -169.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . 0.444 ' HB2' ' O ' ' A' ' 19' ' ' LYS . . . -61.34 -32.59 72.48 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 119.702 -1.874 . . . . 0.0 111.354 169.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -62.18 -24.16 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.814 2.045 . . . . 0.0 114.048 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -115.64 11.43 15.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.368 1.467 . . . . 0.0 113.369 176.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 51.3 ttm -62.88 125.44 23.97 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.644 -1.285 . . . . 0.0 109.939 171.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 155.66 31.14 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.04 -1.038 . . . . 0.0 110.487 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.8 -32.01 73.5 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.163 -1.585 . . . . 0.0 113.186 -172.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.44 -30.94 71.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.804 0.729 . . . . 0.0 112.663 171.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -81.53 -33.88 31.52 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.859 1.664 . . . . 0.0 111.32 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -64.12 -48.51 75.8 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.854 0.861 . . . . 0.0 112.987 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.1 pt -68.9 -4.12 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 176.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.98 -11.48 16.64 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.222 1.809 . . . . 0.0 114.081 172.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 158.41 36.2 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.928 1.24 . . . . 0.0 110.856 175.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 44.1 t-20 -64.45 132.88 95.5 Favored Pre-proline 0 CA--C 1.551 1.003 0 O-C-N 121.246 -0.909 . . . . 0.0 111.871 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 25.4 Cg_exo -63.81 -15.03 46.58 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.921 2.414 . . . . 0.0 114.5 -178.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -55.51 -67.22 0.3 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.325 1.45 . . . . 0.0 108.868 167.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . 0.434 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -74.91 -14.35 60.64 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 33.3 ttm -56.48 -34.56 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.882 -1.136 . . . . 0.0 113.081 175.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 41.5 m -63.16 -58.15 17.45 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . 0.402 ' HG2' HG22 ' A' ' 24' ' ' VAL . 18.5 Cg_endo -55.42 -39.11 92.83 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 123.486 2.791 . . . . 0.0 112.469 169.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.434 HG23 ' O ' ' B' ' 99' ' ' ALA . 68.9 t -60.74 -43.69 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 120.059 -1.651 . . . . 0.0 111.478 176.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.18 -40.01 86.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.461 -0.78 . . . . 0.0 111.554 -175.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.425 ' HB3' ' CH2' ' A' ' 27' ' ' TRP 0.276 0.0 OUTLIER -74.61 -42.52 58.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 116.674 -1.631 . . . . 0.0 111.021 175.042 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.497 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -65.84 -22.5 66.55 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 122.353 2.342 . . . . 0.0 114.15 176.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 3.9 ttp -76.3 -49.45 16.93 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.387 1.075 . . . . 0.0 111.263 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 CA--C 1.544 0.73 0 C-N-CA 123.649 0.779 . . . . 0.0 112.293 -175.441 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 . . . . . 0 N--CA 1.466 0.342 0 CA-C-O 119.08 -0.486 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 97.6 mt -57.17 -30.58 64.61 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.272 0.942 . . . . 0.0 112.584 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 43.7 m -79.21 -36.73 39.67 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.695 0.798 . . . . 0.0 111.77 173.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -83.46 -29.74 27.78 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.67 -44.79 91.06 Favored Pre-proline 0 CA--C 1.553 1.069 0 CA-C-N 120.53 1.514 . . . . 0.0 112.526 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.95 -34.79 10.12 Favored 'Trans proline' 0 C--N 1.352 0.755 0 CA-C-N 122.363 1.88 . . . . 0.0 113.561 171.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -65.6 -33.6 76.27 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.392 -1.442 . . . . 0.0 113.562 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.03 -28.59 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.562 0.619 . . . . 0.0 111.792 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.7 mt -71.31 -48.22 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.5 171.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -54.92 -44.89 74.63 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.15 0.98 . . . . 0.0 111.66 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.57 -32.58 74.25 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.436 -0.79 . . . . 0.0 112.383 -178.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.77 -47.1 61.35 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.443 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.79 -29.98 67.42 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.568 1.531 . . . . 0.0 114.512 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 24.6 pttt -78.69 -23.59 45.51 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -134.64 73.22 68.05 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 125.017 1.327 . . . . 0.0 111.91 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -61.04 -12.71 23.93 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.705 2.937 . . . . 0.0 117.208 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -80.3 -21.52 42.52 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.587 1.155 . . . . 0.0 113.22 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -63.56 152.73 37.87 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.766 0.827 . . . . 0.0 111.795 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -85.97 132.17 34.13 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 66.8 tp -49.8 -43.51 48.58 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -168.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -75.93 -7.9 55.67 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.852 -1.155 . . . . 0.0 113.982 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 58.8 p -57.54 -25.98 60.72 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.343 -1.473 . . . . 0.0 111.38 168.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -70.76 -1.99 13.27 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.794 1.237 . . . . 0.0 113.914 177.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -32.44 50.87 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.65 1.18 . . . . 0.0 111.611 166.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -66.31 -28.5 68.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.506 1.122 . . . . 0.0 112.887 -168.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -73.56 -30.07 62.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.693 1.997 . . . . 0.0 115.757 169.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.508 0 C-N-CA 124.491 1.116 . . . . 0.0 113.856 -167.121 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 . . . . . 0 N--CA 1.446 -0.67 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.1 t -105.06 108.89 20.65 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 120.765 -1.209 . . . . 0.0 112.66 -166.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' B' ' 98' ' ' LYS . . . -63.27 -29.8 71.06 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.796 -1.19 . . . . 0.0 111.209 170.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 14.5 mtmt -60.25 -44.62 95.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.527 1.131 . . . . 0.0 112.281 175.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -99.33 15.02 27.59 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.807 1.243 . . . . 0.0 113.982 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 57.2 ttm -60.78 126.14 26.3 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -78.57 154.75 30.1 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.288 -1.508 . . . . 0.0 110.491 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.51 -34.0 74.76 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.314 -1.491 . . . . 0.0 112.968 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -62.1 -31.61 72.09 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.791 0.836 . . . . 0.0 113.251 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -80.49 -36.03 33.93 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.402 1.481 . . . . 0.0 111.348 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -59.86 -48.85 80.01 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.354 -0.841 . . . . 0.0 111.981 175.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.0 pt -71.51 -2.11 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 125.056 1.342 . . . . 0.0 113.246 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.64 -13.02 16.11 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.343 1.457 . . . . 0.0 113.155 170.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.82 158.6 35.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.313 1.045 . . . . 0.0 111.31 175.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 7.1 t-20 -64.65 139.7 97.83 Favored Pre-proline 0 N--CA 1.48 1.026 0 C-N-CA 123.719 0.808 . . . . 0.0 112.443 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' ASN 0.284 12.1 Cg_exo -78.39 -9.7 16.21 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 CA-C-N 120.809 1.325 . . . . 0.0 114.31 -174.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.602 ' HB2' ' HE2' ' B' ' 87' ' ' MET . 28.6 mttp -66.54 -54.22 26.11 Favored 'General case' 0 C--N 1.356 0.867 0 CA-C-N 120.338 1.426 . . . . 0.0 107.521 166.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.505 ' HB1' HG21 ' B' ' 103' ' ' VAL . . . -79.16 -5.92 55.32 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.5 mtt -58.64 -51.84 68.23 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.351 0.978 . . . . 0.0 111.821 170.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.3 m -54.53 -49.82 88.85 Favored Pre-proline 0 N--CA 1.482 1.159 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -173.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.501 ' HG2' HG22 ' B' ' 103' ' ' VAL . 9.8 Cg_endo -53.5 -45.95 37.29 Favored 'Trans proline' 0 N--CA 1.476 0.489 0 C-N-CA 123.227 2.618 . . . . 0.0 116.47 170.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.31 -41.28 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 120.841 -1.162 . . . . 0.0 112.469 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.26 -27.96 67.68 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.371 1.068 . . . . 0.0 111.125 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 57.6 t90 -82.0 -51.13 8.35 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-O 117.189 -1.386 . . . . 0.0 113.103 170.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.9 t90 -62.96 -31.43 72.53 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 120.652 1.569 . . . . 0.0 110.797 -168.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 62.4 ttp -57.68 -51.88 67.73 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.041 1.336 . . . . 0.0 112.12 167.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 C-N-CA 125.374 1.47 . . . . 0.0 113.887 -175.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 . . . . . 0 N--CA 1.466 0.343 0 CA-C-O 119.696 -0.192 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 81.6 mt -63.56 -26.05 68.52 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.058 -1.026 . . . . 0.0 112.501 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.3 m -75.27 -38.75 60.32 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.015 0.526 . . . . 0.0 110.958 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -86.91 -27.91 23.09 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.041 -0.981 . . . . 0.0 113.628 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.6 mp -51.78 -43.63 88.83 Favored Pre-proline 0 CA--C 1.551 0.998 0 CA-C-N 120.641 1.564 . . . . 0.0 113.005 175.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.21 -39.56 7.4 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 122.054 1.769 . . . . 0.0 113.555 169.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.64 -37.52 87.65 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.431 1.014 . . . . 0.0 112.909 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.49 -26.23 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 177.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.6 mt -73.74 -52.47 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 121.776 -0.578 . . . . 0.0 110.195 173.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -55.45 -49.27 72.89 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.611 0.765 . . . . 0.0 110.502 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -65.45 -25.51 67.55 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.514 -0.741 . . . . 0.0 112.019 -176.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.67 -47.98 15.91 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.125 0.875 . . . . 0.0 112.295 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -26.68 68.4 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.662 1.574 . . . . 0.0 113.748 174.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 mtpp -72.75 -29.03 62.99 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.778 1.631 . . . . 0.0 114.492 169.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -135.04 66.79 68.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.138 1.375 . . . . 0.0 112.397 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -57.65 -13.55 14.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 123.514 2.809 . . . . 0.0 116.914 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -83.97 -21.06 31.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.226 1.41 . . . . 0.0 113.762 -178.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -69.06 156.0 39.39 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.928 0.891 . . . . 0.0 111.775 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -92.84 122.75 35.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.7 tp -42.69 -52.9 4.74 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -165.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.411 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.4 m-85 -68.32 -8.11 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -173.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -55.69 -28.16 54.12 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 121.021 -1.049 . . . . 0.0 111.294 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -71.99 -1.22 13.77 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.642 1.577 . . . . 0.0 114.336 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -31.61 25.89 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.183 1.356 . . . . 0.0 110.936 166.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.53 -26.65 64.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.937 0.895 . . . . 0.0 111.909 -170.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -72.97 -28.99 62.73 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.553 1.541 . . . . 0.0 114.937 171.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.647 0 C-N-CA 125.165 1.386 . . . . 0.0 113.78 -167.854 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.501 ' HB3' ' HG2' ' A' ' 19' ' ' LYS . 3.2 mm-40 . . . . . 0 CA--C 1.548 0.873 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.1 t -105.38 103.51 13.05 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 120.264 -1.523 . . . . 0.0 113.746 -164.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.21 -35.68 67.59 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.758 -1.214 . . . . 0.0 110.275 170.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -66.53 -20.61 66.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.398 2.279 . . . . 0.0 115.512 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -123.65 9.4 8.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.628 1.171 . . . . 0.0 113.213 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . 0.602 ' HE2' ' HB2' ' A' ' 19' ' ' LYS . 27.9 ttm -61.4 134.04 56.47 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 120.552 -1.342 . . . . 0.0 109.858 169.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 9.3 p -71.81 169.85 14.88 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 121.948 0.88 . . . . 0.0 112.381 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.2 m -70.37 -38.68 74.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.933 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -63.78 -37.73 88.45 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.416 1.007 . . . . 0.0 112.37 173.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -73.12 -39.03 66.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.483 1.113 . . . . 0.0 111.598 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -61.5 -49.46 76.66 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.431 -0.793 . . . . 0.0 113.105 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.3 pt -68.41 -4.72 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 176.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -105.9 -10.75 16.48 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.282 1.833 . . . . 0.0 114.058 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 158.84 34.72 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.767 1.167 . . . . 0.0 110.887 176.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -58.11 134.21 84.18 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.186 0.995 . . . . 0.0 113.164 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.95 -16.86 32.49 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 122.693 2.262 . . . . 0.0 115.686 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 5' ' ' ALA . 9.0 mptt -63.7 -49.23 73.93 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 121.003 1.729 . . . . 0.0 109.716 170.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . 0.487 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -86.38 -16.03 38.58 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.4 ttm -54.6 -34.86 62.68 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.462 -1.399 . . . . 0.0 113.236 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 56.3 m -65.58 -57.38 14.61 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-O 117.535 -1.222 . . . . 0.0 112.911 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -52.79 -38.72 78.25 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.881 3.054 . . . . 0.0 114.444 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.505 HG21 ' HB1' ' A' ' 20' ' ' ALA . 58.4 t -62.83 -52.61 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 121.9 -0.5 . . . . 0.0 111.286 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.94 -40.99 95.37 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.291 1.037 . . . . 0.0 110.842 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 82.5 t90 -68.19 -50.04 56.89 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.577 -1.201 . . . . 0.0 112.626 175.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.414 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.2 t90 -67.77 -29.91 69.23 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 120.746 1.612 . . . . 0.0 111.56 -168.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.8 tmm? -60.41 -48.5 81.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.578 1.151 . . . . 0.0 111.577 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.545 0.78 0 C-N-CA 124.89 1.276 . . . . 0.0 113.18 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 119.802 -0.142 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -56.01 -32.61 64.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.748 0.819 . . . . 0.0 112.265 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 26.1 m -80.86 -38.53 27.98 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.648 0.779 . . . . 0.0 112.287 173.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -78.0 -31.83 50.84 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 117.321 -1.324 . . . . 0.0 114.452 -175.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.51 -46.37 90.55 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 121.2 1.818 . . . . 0.0 112.998 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.25 -38.54 8.77 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 121.941 1.729 . . . . 0.0 113.428 172.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -67.54 -31.73 72.02 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.746 -1.221 . . . . 0.0 113.773 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.3 -26.86 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 118.384 0.538 . . . . 0.0 111.994 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 39.7 mt -71.0 -50.18 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.701 0.8 . . . . 0.0 109.715 171.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.93 -45.48 82.7 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.759 0.824 . . . . 0.0 111.813 175.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.88 -24.87 65.28 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.653 -1.279 . . . . 0.0 112.299 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.9 -46.94 19.89 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.916 0.78 . . . . 0.0 112.207 176.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -26.19 68.04 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 120.363 1.438 . . . . 0.0 113.981 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -68.92 -31.1 69.77 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 168.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -133.05 63.83 68.27 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 124.872 1.269 . . . . 0.0 112.322 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -56.9 -20.03 34.43 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.166 2.578 . . . . 0.0 116.435 -171.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -80.2 -16.77 54.07 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.605 1.162 . . . . 0.0 113.283 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -74.25 165.89 24.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.612 1.165 . . . . 0.0 112.219 -172.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -80.46 151.57 29.21 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 49.2 tp -68.56 -38.97 81.21 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.2 -20.16 30.59 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -169.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.8 t -62.06 -16.47 52.23 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.048 -1.033 . . . . 0.0 112.127 171.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.5 -4.04 5.31 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 119.512 -1.992 . . . . 0.0 114.336 168.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.13 -28.35 35.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.293 1.437 . . . . 0.0 111.988 166.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.17 -35.47 81.19 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.175 1.39 . . . . 0.0 112.075 -174.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -70.78 -28.22 64.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.348 1.859 . . . . 0.0 114.948 173.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -167.598 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 118.55 -0.738 . . . . 0.0 112.681 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 93.75 104.4 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.982 2.913 . . . . 0.0 117.45 167.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.49 -29.06 68.83 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 119.855 -1.778 . . . . 0.0 112.306 169.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 7.7 mtmt -65.28 -30.85 71.75 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.145 1.378 . . . . 0.0 114.118 174.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -100.8 4.95 43.32 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.479 1.111 . . . . 0.0 113.077 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.9 ttm -63.89 139.83 58.81 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 119.604 1.093 . . . . 0.0 110.487 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.3 p -78.44 175.88 9.89 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.038 -1.038 . . . . 0.0 112.247 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.31 -39.72 53.36 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.702 171.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.78 -35.96 79.69 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.11 0.868 . . . . 0.0 112.23 171.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -75.72 -38.55 58.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.66 1.184 . . . . 0.0 111.948 176.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -57.5 -50.58 72.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 121.478 -0.764 . . . . 0.0 112.792 176.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.9 pt -68.26 -4.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 C-N-CA 124.094 0.958 . . . . 0.0 112.519 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -106.98 -13.61 15.16 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.337 1.455 . . . . 0.0 114.291 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.73 163.77 27.18 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 120.892 -1.13 . . . . 0.0 111.048 173.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.49 HD21 ' HD3' ' A' ' 19' ' ' LYS . 44.0 t-20 -65.07 131.52 95.19 Favored Pre-proline 0 N--CA 1.484 1.23 0 O-C-N 120.683 -1.261 . . . . 0.0 112.531 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.94 -16.16 37.08 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.82 3.014 . . . . 0.0 115.669 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.49 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.9 mptt -58.17 -65.49 0.64 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 125.776 1.631 . . . . 0.0 108.899 167.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.456 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -78.02 -9.61 59.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -177.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 83.7 mtp -58.1 -35.97 72.2 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.797 1.181 . . . . 0.0 112.749 171.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.5 m -64.19 -55.95 27.56 Favored Pre-proline 0 N--CA 1.484 1.236 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.23 -35.31 95.39 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.325 2.683 . . . . 0.0 114.224 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 20' ' ' ALA . 95.1 t -63.1 -52.36 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.392 0.677 . . . . 0.0 111.617 173.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.97 -39.32 91.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.045 1.338 . . . . 0.0 110.708 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 72.4 t90 -67.74 -51.86 44.3 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-O 116.944 -1.503 . . . . 0.0 112.644 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.455 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.4 t90 -67.28 -25.05 65.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.973 1.715 . . . . 0.0 111.7 -169.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -67.66 -46.19 73.1 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.448 1.099 . . . . 0.0 111.702 169.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.57 -26.89 68.82 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.316 -0.865 . . . . 0.0 111.794 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.4 m -77.91 -36.21 49.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.221 1.008 . . . . 0.0 111.502 171.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.99 -28.97 29.33 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.31 -39.69 73.61 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-O 117.176 -1.392 . . . . 0.0 112.78 177.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.597 ' HA ' HD12 ' A' ' 55' ' ' ILE . 44.8 Cg_endo -73.98 -37.94 2.51 Favored 'Trans proline' 0 C--N 1.354 0.825 0 CA-C-N 122.307 1.859 . . . . 0.0 113.317 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -66.46 -32.41 73.75 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.486 -1.383 . . . . 0.0 113.683 -176.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.62 -17.31 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.597 HD12 ' HA ' ' A' ' 52' ' ' PRO . 11.3 mt -83.45 -52.82 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.416 1.087 . . . . 0.0 109.633 172.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -56.41 -49.9 73.19 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.027 0.931 . . . . 0.0 110.735 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -62.34 -24.77 67.53 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.438 -0.789 . . . . 0.0 111.596 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.73 -47.39 14.03 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.397 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -27.87 69.58 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.848 1.658 . . . . 0.0 113.696 172.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -73.02 -30.52 63.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.787 1.635 . . . . 0.0 115.115 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -131.59 66.62 78.64 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.227 1.411 . . . . 0.0 110.479 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -60.57 -14.36 30.5 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.592 2.861 . . . . 0.0 114.646 -174.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -79.12 -26.29 42.88 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.158 1.783 . . . . 0.0 112.685 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -69.17 162.71 26.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.65 1.18 . . . . 0.0 112.624 -169.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -94.82 131.4 40.74 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.2 tp -52.29 -35.81 51.28 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -166.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.267 5.0 m-85 -82.55 -5.45 58.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.351 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 60.5 p -60.49 -27.81 67.87 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 120.168 -1.583 . . . . 0.0 111.357 168.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -70.6 -4.11 21.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.512 1.525 . . . . 0.0 114.114 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -32.2 40.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.994 1.717 . . . . 0.0 111.316 169.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -72.7 -25.45 61.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.089 1.356 . . . . 0.0 112.176 -171.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -76.19 -31.59 58.55 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -167.761 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 21.0 t -94.26 99.51 11.74 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 120.672 -1.268 . . . . 0.0 113.689 -166.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.32 -33.6 63.45 Favored 'General case' 0 CA--C 1.554 1.123 0 O-C-N 120.827 -1.17 . . . . 0.0 110.911 169.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.43 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 13.5 mtmt -62.54 -37.77 87.41 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.679 1.992 . . . . 0.0 114.199 176.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -106.63 12.82 28.91 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.927 1.291 . . . . 0.0 112.672 -178.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 60.2 ttm -58.48 132.17 52.93 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 121.108 -0.995 . . . . 0.0 108.5 169.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 11.7 p -74.56 172.35 12.17 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.218 -0.926 . . . . 0.0 111.765 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.58 -36.22 73.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.94 170.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -63.67 -35.89 82.05 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.361 0.982 . . . . 0.0 112.462 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.01 -34.75 50.53 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.921 1.288 . . . . 0.0 111.885 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . 0.538 ' HA ' HD12 ' B' ' 95' ' ' LEU . 93.6 t80 -68.7 -37.13 79.29 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.964 -1.085 . . . . 0.0 113.52 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.4 pt -77.64 3.8 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 O-C-N 120.844 -1.16 . . . . 0.0 112.026 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -120.03 -32.24 4.24 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -177.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' B' ' 92' ' ' PHE . 0.0 OUTLIER -64.42 162.81 14.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.231 1.832 . . . . 0.0 111.906 172.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.491 HD21 ' HD3' ' B' ' 98' ' ' LYS . 48.5 t-20 -63.69 132.22 95.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.805 -168.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.0 -22.22 29.92 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.029 3.153 . . . . 0.0 115.378 176.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.491 ' HD3' HD21 ' B' ' 96' ' ' ASN . 14.6 mttt -56.64 -59.83 4.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.125 1.77 . . . . 0.0 109.365 167.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.75 -14.74 47.35 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 30.5 ttm -53.92 -36.18 62.48 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.947 0.899 . . . . 0.0 111.197 168.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 28.4 m -65.97 -57.65 13.01 Favored Pre-proline 0 N--CA 1.479 0.986 0 CA-C-O 117.862 -1.066 . . . . 0.0 112.818 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -51.23 -41.79 56.68 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.983 3.122 . . . . 0.0 115.188 170.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.92 -37.8 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.606 1.094 . . . . 0.0 113.289 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.16 -33.91 76.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.234 0.613 . . . . 0.0 111.047 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 84.6 t90 -75.91 -50.38 15.17 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-O 117.722 -1.132 . . . . 0.0 112.349 175.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.436 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 1.5 t90 -67.06 -25.51 66.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 117.924 -1.51 . . . . 0.0 111.16 -170.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 54.9 ttp -60.97 -53.36 58.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.638 1.175 . . . . 0.0 111.319 168.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.547 0.846 0 C-N-CA 124.775 1.23 . . . . 0.0 112.411 178.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 119.421 -0.323 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.9 mt -57.17 -27.13 61.64 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.756 0.707 . . . . 0.0 112.624 174.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.4 m -81.08 -37.84 28.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.492 1.117 . . . . 0.0 111.783 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -84.47 -29.95 25.64 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.895 1.442 . . . . 0.0 114.895 -175.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.15 -44.51 98.6 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 120.489 1.495 . . . . 0.0 112.111 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.27 -35.64 18.34 Favored 'Trans proline' 0 C--N 1.353 0.781 0 CA-C-N 122.205 1.823 . . . . 0.0 113.718 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.76 -38.66 91.45 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.453 1.479 . . . . 0.0 112.869 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 m -69.09 -29.19 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.41 -52.15 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.08 0.952 . . . . 0.0 109.9 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -58.19 -42.83 86.97 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.814 0.846 . . . . 0.0 112.386 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -68.32 -27.64 66.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.809 0.844 . . . . 0.0 112.454 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.46 -48.92 15.93 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.364 -0.835 . . . . 0.0 112.906 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -24.93 66.06 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -75.42 -23.36 56.99 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 170.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -138.6 71.95 43.59 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.603 1.161 . . . . 0.0 111.997 172.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -59.14 -16.96 36.14 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.615 2.877 . . . . 0.0 116.772 -172.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -78.33 -16.98 57.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.596 1.158 . . . . 0.0 113.32 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -71.91 164.96 25.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.017 1.327 . . . . 0.0 111.717 -174.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -80.7 159.18 25.34 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 110.366 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.58 -64.82 0.91 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.775 -0.578 . . . . 0.0 112.395 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.43 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 2.7 m-85 -62.49 -21.3 65.38 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -167.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.8 t -55.87 -26.17 45.75 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.477 -0.764 . . . . 0.0 112.31 171.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -64.71 -2.29 2.39 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.823 -1.798 . . . . 0.0 113.748 173.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -72.28 -34.74 68.42 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.668 1.122 . . . . 0.0 111.839 165.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.52 -32.95 73.01 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -167.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' B' ' 151' ' ' GLN . 8.1 pt20 -73.55 -28.02 61.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.127 2.171 . . . . 0.0 115.706 175.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -165.857 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 pm0 . . . . . 0 N--CA 1.442 -0.828 0 CA-C-O 123.263 1.506 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.502 ' H ' ' HG3' ' B' ' 98' ' ' LYS . 26.8 t -148.4 88.5 1.64 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 113.853 -1.522 . . . . 0.0 109.335 167.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' B' ' 98' ' ' LYS . . . -57.69 -31.74 66.67 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.653 -1.279 . . . . 0.0 110.74 171.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 8.9 mttt -50.12 -49.55 51.44 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.602 1.961 . . . . 0.0 111.728 170.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -100.71 16.43 24.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.287 1.435 . . . . 0.0 113.842 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -55.83 124.13 16.52 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 167.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.5 t -75.48 153.12 37.73 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 120.9 -1.125 . . . . 0.0 110.141 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.23 -32.7 73.41 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.063 -1.648 . . . . 0.0 112.935 -175.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -64.93 -31.0 72.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.91 0.884 . . . . 0.0 112.606 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -77.96 -37.7 46.88 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.193 1.397 . . . . 0.0 111.556 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.98 -49.41 77.77 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.455 -0.778 . . . . 0.0 112.885 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.3 pt -68.42 -5.79 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.669 1.188 . . . . 0.0 113.152 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -110.6 -8.45 14.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.811 1.644 . . . . 0.0 113.74 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.92 159.54 32.65 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 121.057 -1.027 . . . . 0.0 110.329 175.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -65.43 128.65 93.98 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 121.19 -0.944 . . . . 0.0 111.837 -173.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.62 -15.56 12.66 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.777 2.985 . . . . 0.0 115.567 178.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -62.5 -72.41 0.13 Allowed 'General case' 0 C--N 1.349 0.557 0 C-N-CA 126.423 1.889 . . . . 0.0 109.463 166.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.51 -4.11 43.95 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -177.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.9 ttt -58.18 -39.95 80.22 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 112.92 170.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.263 20.1 m -66.21 -51.39 44.85 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -50.16 -45.12 34.92 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.453 2.768 . . . . 0.0 115.841 169.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 p -73.69 -39.0 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.204 0.911 . . . . 0.0 113.358 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.72 -26.3 68.61 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.197 0.999 . . . . 0.0 111.676 172.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 65.5 t90 -83.61 -51.78 7.01 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.378 171.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.453 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.9 t90 -66.02 -34.85 79.03 Favored 'General case' 0 C--N 1.348 0.521 0 CA-C-N 120.329 1.422 . . . . 0.0 112.026 -167.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -55.85 -38.82 70.58 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.694 1.198 . . . . 0.0 112.168 171.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 125.257 1.423 . . . . 0.0 112.853 -169.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 . . . . . 0 N--CA 1.468 0.429 0 CA-C-O 119.355 -0.355 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.33 -29.29 68.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.591 0.756 . . . . 0.0 112.259 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.7 m -78.74 -34.05 46.1 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.871 1.268 . . . . 0.0 111.857 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -79.14 -26.56 42.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.466 -1.254 . . . . 0.0 113.139 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mm -53.74 -46.13 98.49 Favored Pre-proline 0 N--CA 1.479 0.976 0 CA-C-N 120.327 1.421 . . . . 0.0 112.76 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.22 -37.24 14.57 Favored 'Trans proline' 0 C--N 1.352 0.731 0 CA-C-N 121.701 1.643 . . . . 0.0 113.141 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.88 -37.3 85.76 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.829 -1.169 . . . . 0.0 113.364 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.72 -16.96 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.221 0.608 . . . . 0.0 112.582 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mt -85.12 -49.69 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 124.238 1.015 . . . . 0.0 110.232 171.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -57.47 -39.62 76.76 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.949 0.9 . . . . 0.0 111.758 176.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -71.38 -23.63 61.93 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.19 -0.943 . . . . 0.0 111.67 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -81.09 -44.2 18.34 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.051 -1.031 . . . . 0.0 112.151 175.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -27.4 69.28 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 120.549 1.522 . . . . 0.0 113.698 172.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -71.76 -35.79 70.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -126.98 62.2 50.77 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.876 1.27 . . . . 0.0 111.376 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.96 -17.15 10.28 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.707 3.605 . . . . 0.0 116.071 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -83.28 -22.9 32.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.589 1.555 . . . . 0.0 113.183 -176.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -68.53 159.24 32.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.077 0.951 . . . . 0.0 112.473 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -97.54 118.15 33.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 -175.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -43.24 -43.88 5.01 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -165.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.443 ' CG ' ' HA ' ' A' ' 6' ' ' LYS 0.251 4.3 m-30 -72.01 -8.23 53.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 120.445 1.475 . . . . 0.0 114.06 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.2 p -58.74 -27.48 64.98 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 120.255 -1.528 . . . . 0.0 111.838 167.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -70.54 -11.67 61.08 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.581 -1.324 . . . . 0.0 112.664 177.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -68.8 -30.68 69.3 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.516 1.127 . . . . 0.0 112.057 169.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -69.41 -16.67 63.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 112.003 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -79.79 -26.37 40.62 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.266 2.226 . . . . 0.0 114.396 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -163.338 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t 102.79 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 129.525 3.13 . . . . 0.0 116.975 166.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.7 -39.73 68.47 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.391 -1.443 . . . . 0.0 111.287 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.424 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 4.4 ptpt -77.08 1.65 17.45 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -127.08 6.84 6.53 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.084 1.354 . . . . 0.0 112.64 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 33.4 ttm -62.2 137.43 58.25 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.778 -1.201 . . . . 0.0 110.046 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 22.2 p -74.18 167.51 21.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.124 0.964 . . . . 0.0 111.727 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.73 -36.28 73.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.826 170.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -63.12 -36.96 85.35 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.161 0.891 . . . . 0.0 112.58 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -75.86 -38.72 57.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.941 0.896 . . . . 0.0 111.874 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -59.94 -45.38 92.81 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.189 -0.944 . . . . 0.0 113.08 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -71.45 -0.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 118.89 0.768 . . . . 0.0 112.665 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -119.03 -14.77 9.33 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 126.331 1.853 . . . . 0.0 114.949 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.64 159.15 13.8 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.956 1.253 . . . . 0.0 111.234 173.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -73.31 130.7 83.96 Favored Pre-proline 0 N--CA 1.482 1.151 0 O-C-N 120.72 -1.238 . . . . 0.0 110.263 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -58.18 -26.93 78.35 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 121.69 1.593 . . . . 0.0 114.445 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.502 ' HG3' ' H ' ' A' ' 4' ' ' SER . 6.5 mptt -56.7 -15.07 3.88 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 121.459 1.936 . . . . 0.0 114.604 175.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -123.38 21.37 9.51 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 122.791 2.541 . . . . 0.0 114.61 167.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 35.7 ttm -73.42 -57.84 3.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.44 1.496 . . . . 0.0 112.503 172.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.6 m -49.58 -52.35 51.11 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.35 -45.26 40.74 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.996 3.13 . . . . 0.0 115.792 172.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.2 p -75.63 -39.84 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 120.749 1.613 . . . . 0.0 112.785 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.82 -31.58 69.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.776 0.83 . . . . 0.0 111.252 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 37.5 t90 -83.06 -47.18 11.95 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.556 -1.211 . . . . 0.0 112.102 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.413 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -68.84 -24.1 64.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 121.208 1.822 . . . . 0.0 111.128 -170.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.09 -46.91 79.14 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.935 1.294 . . . . 0.0 111.51 169.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.6 mm? . . . . . 0 CA--C 1.548 0.872 0 C-N-CA 125.173 1.389 . . . . 0.0 113.187 173.359 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 76.0 mt -52.82 -34.91 56.03 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.264 1.025 . . . . 0.0 113.009 174.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 58.7 m -75.72 -33.15 60.29 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.375 0.67 . . . . 0.0 111.596 175.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -81.03 -25.1 37.43 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 179.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.1 mm -54.42 -44.35 98.75 Favored Pre-proline 0 CA--C 1.555 1.161 0 CA-C-N 120.187 1.358 . . . . 0.0 112.173 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.98 -34.38 10.59 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.821 1.686 . . . . 0.0 113.204 171.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -66.1 -32.39 73.82 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.659 -1.276 . . . . 0.0 113.604 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.09 -25.9 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.663 0.665 . . . . 0.0 112.481 173.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.5 mt -73.62 -53.06 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.797 0.839 . . . . 0.0 109.546 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.42 -44.21 84.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.935 0.894 . . . . 0.0 112.184 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -71.44 -24.48 62.03 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.99 -1.069 . . . . 0.0 112.172 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.88 -46.01 22.57 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.118 -0.989 . . . . 0.0 112.055 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -26.03 68.59 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 120.28 1.4 . . . . 0.0 113.778 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -72.85 -32.34 65.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 168.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -129.34 60.51 51.62 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.22 1.408 . . . . 0.0 111.11 -175.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -60.17 -17.07 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.747 2.965 . . . . 0.0 115.424 -169.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -80.39 -18.01 50.18 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.668 1.187 . . . . 0.0 113.355 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -71.79 165.97 22.99 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.252 1.021 . . . . 0.0 112.429 -172.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -92.49 130.82 38.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 55.0 tp -46.71 -34.51 5.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.271 1.828 . . . . 0.0 114.092 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.424 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.2 m-85 -84.66 -8.71 58.77 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.6 p -62.81 -25.59 68.32 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.564 -1.335 . . . . 0.0 111.391 168.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -71.5 -2.98 18.7 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.28 1.432 . . . . 0.0 114.204 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -32.17 41.35 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.942 1.297 . . . . 0.0 111.277 167.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -72.44 -31.04 65.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.639 1.176 . . . . 0.0 112.431 -169.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -67.82 -30.0 69.3 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.701 1.6 . . . . 0.0 114.662 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.447 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -167.28 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 118.704 -0.665 . . . . 0.0 111.411 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t 93.42 98.85 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.571 2.748 . . . . 0.0 117.217 165.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.27 -30.33 66.5 Favored 'General case' 0 CA--C 1.556 1.19 0 O-C-N 120.211 -1.556 . . . . 0.0 112.06 172.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 11.1 mtmt -64.91 -20.51 66.48 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.821 1.649 . . . . 0.0 114.869 173.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -114.5 7.36 16.17 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.035 1.334 . . . . 0.0 113.053 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -63.12 123.93 19.85 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.68 -1.263 . . . . 0.0 109.771 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.62 155.35 29.62 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.156 -0.965 . . . . 0.0 110.379 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -63.5 -33.46 75.64 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 120.247 -1.533 . . . . 0.0 113.291 -174.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.13 -32.99 73.64 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 171.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -78.93 -36.42 41.8 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.123 1.369 . . . . 0.0 111.774 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.09 -49.31 78.17 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.402 -0.811 . . . . 0.0 112.502 177.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -68.51 -2.54 2.03 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 124.743 1.217 . . . . 0.0 112.856 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -113.49 -11.1 13.12 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.872 1.669 . . . . 0.0 113.826 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.23 155.64 38.32 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 121.116 -0.99 . . . . 0.0 110.726 172.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -68.36 132.82 91.35 Favored Pre-proline 0 N--CA 1.48 1.043 0 O-C-N 121.052 -1.03 . . . . 0.0 111.231 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -45.49 -35.42 12.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.304 3.336 . . . . 0.0 114.466 175.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' B' ' 83' ' ' SER . 38.7 mttt -61.2 -19.06 61.17 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -127.52 19.53 6.78 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.655 1.57 . . . . 0.0 114.207 166.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 47.6 mtp -65.79 -58.73 4.95 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.784 0.833 . . . . 0.0 111.961 168.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 m -40.96 -55.31 4.86 Favored Pre-proline 0 N--CA 1.494 1.755 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -58.04 -39.43 85.9 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 123.791 2.994 . . . . 0.0 115.806 175.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.8 -38.4 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.807 1.185 . . . . 0.0 112.632 174.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.96 -21.35 66.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.303 1.041 . . . . 0.0 111.573 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.452 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 70.9 t90 -92.36 -49.12 6.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 116.986 -1.483 . . . . 0.0 112.973 168.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -69.27 -22.87 63.79 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 121.744 2.065 . . . . 0.0 112.512 -169.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.0 tmm? -70.76 -34.42 71.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.327 -0.858 . . . . 0.0 111.592 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.544 0.717 0 C-N-CA 125.953 1.701 . . . . 0.0 111.99 -177.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 C--O 1.221 -0.418 0 CA-C-O 119.326 -0.369 . . . . 0.0 110.97 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.76 -23.03 66.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.376 0.989 . . . . 0.0 111.433 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.0 m -79.43 -37.3 37.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.055 0.942 . . . . 0.0 111.529 169.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -85.96 -27.06 25.14 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.26 -42.07 89.46 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-N 120.455 1.48 . . . . 0.0 112.385 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.58 -37.79 6.79 Favored 'Trans proline' 0 C--N 1.355 0.911 0 CA-C-N 121.97 1.739 . . . . 0.0 113.186 169.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt -66.81 -32.67 74.1 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.225 -1.547 . . . . 0.0 113.839 -176.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.7 m -69.07 -20.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 119.011 0.823 . . . . 0.0 112.949 173.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.0 mt -83.95 -51.04 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.043 0.937 . . . . 0.0 110.023 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.45 -38.84 78.34 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.152 0.981 . . . . 0.0 111.969 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.94 -30.28 68.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.556 0.616 . . . . 0.0 111.305 177.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -76.62 -42.51 42.02 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 120.934 -1.104 . . . . 0.0 113.072 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.71 -29.62 68.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 120.877 1.671 . . . . 0.0 113.914 177.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.425 ' HG3' HD22 ' A' ' 61' ' ' ASN . 14.3 ptpt -80.11 -29.19 38.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.425 HD22 ' HG3' ' A' ' 60' ' ' LYS . 24.3 m-80 -129.81 70.74 82.13 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.521 1.528 . . . . 0.0 111.121 174.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -59.53 -11.74 15.02 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.859 3.706 . . . . 0.0 116.254 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -83.69 -21.48 32.37 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.355 1.462 . . . . 0.0 113.146 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -69.1 157.4 36.91 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.113 0.965 . . . . 0.0 111.49 -174.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -94.39 134.54 36.78 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.8 tp -51.85 -38.85 57.54 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -168.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.448 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 5.2 m-85 -79.6 -5.88 55.92 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.7 p -61.41 -27.58 68.64 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.043 -1.661 . . . . 0.0 110.948 167.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.41 -2.91 24.28 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.417 1.487 . . . . 0.0 113.487 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -31.48 37.53 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.548 1.539 . . . . 0.0 111.714 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -70.22 -26.66 63.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.742 1.217 . . . . 0.0 112.198 -171.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -79.34 -31.16 42.98 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.763 1.625 . . . . 0.0 115.056 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.545 0 C-N-CA 124.614 1.165 . . . . 0.0 113.602 -167.27 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.427 -1.616 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 19' ' ' LYS . 20.2 m -137.03 56.53 1.79 Allowed 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 124.032 0.933 . . . . 0.0 109.26 168.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.68 -39.79 68.45 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.546 -1.347 . . . . 0.0 109.677 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.452 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 2.4 ptpt -68.18 -6.31 22.69 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.449 2.699 . . . . 0.0 116.527 175.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -138.42 18.4 2.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.495 1.518 . . . . 0.0 112.143 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . 0.428 ' HE1' HD22 ' B' ' 95' ' ' LEU . 23.4 ttm -60.09 123.76 18.13 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 120.023 1.283 . . . . 0.0 108.143 177.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.8 t -76.6 152.15 36.0 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.065 -175.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.195 -1.566 . . . . 0.0 112.763 -170.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -32.42 71.92 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 119.34 0.973 . . . . 0.0 112.38 173.5 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.41 -37.3 63.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.538 1.535 . . . . 0.0 111.231 174.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -64.01 -49.75 71.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.652 1.181 . . . . 0.0 113.203 175.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.0 pt -68.66 -3.88 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 176.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -103.78 -10.13 18.51 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.073 1.749 . . . . 0.0 114.053 169.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . 0.428 HD22 ' HE1' ' B' ' 87' ' ' MET . 0.2 OUTLIER -70.77 160.76 32.11 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.702 -1.249 . . . . 0.0 110.464 171.006 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.448 HD21 ' HD2' ' B' ' 98' ' ' LYS . 53.8 t-20 -69.44 130.47 90.75 Favored Pre-proline 0 N--CA 1.481 1.122 0 O-C-N 121.376 -0.827 . . . . 0.0 111.942 -178.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.13 -19.95 35.79 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.57 2.847 . . . . 0.0 115.614 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.448 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.8 mttt -55.81 -66.19 0.47 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.487 1.915 . . . . 0.0 110.386 168.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.37 -6.57 59.4 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.6 ttm -58.37 -38.02 76.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.97 -1.081 . . . . 0.0 111.313 168.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 63.3 m -60.48 -56.75 32.21 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 124.346 1.058 . . . . 0.0 112.598 -177.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -52.85 -44.61 46.95 Favored 'Trans proline' 0 C--N 1.357 1.001 0 C-N-CA 124.187 3.258 . . . . 0.0 115.408 171.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.21 -37.21 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 120.442 1.474 . . . . 0.0 112.896 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.79 -24.93 67.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.629 0.771 . . . . 0.0 110.975 175.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.505 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.4 t90 -83.14 -51.16 7.75 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.496 168.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.505 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.3 t90 -64.98 -33.55 76.31 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.673 1.579 . . . . 0.0 111.278 -168.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -57.17 -44.24 83.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.734 1.214 . . . . 0.0 112.352 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.544 0.732 0 C-N-CA 125.294 1.438 . . . . 0.0 111.909 -173.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.8 mt -58.13 -30.5 66.38 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.251 1.02 . . . . 0.0 112.515 175.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 91.2 m -80.29 -37.19 33.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.587 1.155 . . . . 0.0 112.104 174.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -74.15 -31.88 62.9 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.519 -1.363 . . . . 0.0 113.602 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.59 -51.84 75.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 120.068 1.304 . . . . 0.0 112.208 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.64 -33.19 36.48 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 CA-C-N 121.922 1.722 . . . . 0.0 113.5 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -62.99 -41.43 99.57 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.625 1.557 . . . . 0.0 113.008 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.44 -28.35 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.832 -0.542 . . . . 0.0 112.427 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 54.6 mt -67.23 -47.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.302 0.501 . . . . 0.0 110.318 172.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -57.99 -44.31 87.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.857 0.863 . . . . 0.0 111.624 172.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.73 -23.45 63.2 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.942 -1.099 . . . . 0.0 113.173 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.34 -51.12 8.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.626 1.103 . . . . 0.0 112.434 175.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -26.65 68.51 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 120.614 1.552 . . . . 0.0 113.508 173.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -73.02 -29.79 63.27 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.467 1.507 . . . . 0.0 114.663 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -131.63 64.87 74.45 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.51 -15.35 40.73 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.851 3.034 . . . . 0.0 116.483 -168.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -84.33 -12.84 53.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.561 1.144 . . . . 0.0 114.051 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -77.48 163.54 26.24 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.726 1.21 . . . . 0.0 112.529 -170.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -79.18 143.89 34.97 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.837 -0.54 . . . . 0.0 109.813 169.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.78 -39.51 85.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.452 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 3.0 m-30 -82.65 -26.7 31.92 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.9 t -61.58 -19.18 61.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.903 -1.123 . . . . 0.0 112.187 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.68 -4.19 1.9 Allowed 'General case' 0 CA--C 1.538 0.518 0 O-C-N 119.554 -1.966 . . . . 0.0 113.957 171.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -33.68 71.58 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.554 1.07 . . . . 0.0 111.965 166.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.01 -32.42 73.78 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -167.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' B' ' 151' ' ' GLN . 8.3 pt20 -71.06 -28.2 64.19 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.744 2.018 . . . . 0.0 115.154 172.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -167.34 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.553 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.422 -1.852 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.429 ' H ' ' HG2' ' B' ' 98' ' ' LYS . 17.3 m -128.94 57.58 1.62 Allowed 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 123.402 0.681 . . . . 0.0 109.947 169.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.553 ' H ' ' HG2' ' A' ' 3' ' ' GLU . . . -53.35 -40.64 65.08 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.166 1.348 . . . . 0.0 109.414 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.469 ' HA ' ' CD2' ' A' ' 67' ' ' TYR . 3.0 mppt? -45.39 -29.03 0.97 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 130.592 3.557 . . . . 0.0 114.893 169.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -134.77 21.99 3.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.963 1.705 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.526 ' HE1' HD22 ' A' ' 16' ' ' LEU . 20.4 ttm -60.05 120.02 8.91 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.3 t -74.97 152.1 38.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -173.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.35 -28.4 69.26 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.624 -1.297 . . . . 0.0 113.165 -170.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.41 90.94 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.886 0.766 . . . . 0.0 111.595 169.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -70.47 -37.14 74.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.257 1.023 . . . . 0.0 111.949 175.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -59.38 -52.29 66.27 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.349 -0.845 . . . . 0.0 112.812 174.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.2 pt -69.87 0.93 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 112.627 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -112.61 -14.76 13.14 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.072 1.749 . . . . 0.0 114.02 173.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.526 HD22 ' HE1' ' A' ' 8' ' ' MET . 0.3 OUTLIER -67.03 162.72 21.51 Favored 'General case' 0 CA--C 1.552 1.049 0 O-C-N 120.88 -1.137 . . . . 0.0 110.127 169.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.519 HD21 ' HD3' ' A' ' 19' ' ' LYS . 50.4 t-20 -68.22 129.93 92.68 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 120.823 -1.173 . . . . 0.0 112.409 -175.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 38.8 Cg_exo -58.81 -12.31 14.45 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.269 3.312 . . . . 0.0 116.15 176.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.519 ' HD3' HD21 ' A' ' 17' ' ' ASN . 7.6 mttt -65.37 -63.06 1.19 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.334 1.854 . . . . 0.0 108.669 166.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.62 0.92 44.75 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 72.8 mtp -59.54 -38.5 81.22 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.818 -1.176 . . . . 0.0 112.116 169.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 21.8 m -66.64 -51.53 39.97 Favored Pre-proline 0 N--CA 1.48 1.045 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -49.5 -46.75 25.32 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.66 2.907 . . . . 0.0 116.132 169.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.09 -39.65 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 120.954 -1.091 . . . . 0.0 112.765 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.12 -27.33 68.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.558 0.743 . . . . 0.0 111.803 173.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 81.1 t90 -83.43 -52.21 6.72 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.727 171.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.434 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.4 t90 -66.05 -34.63 78.53 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 120.213 1.37 . . . . 0.0 111.517 -168.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -56.58 -42.83 79.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.988 1.315 . . . . 0.0 111.731 171.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.546 0.817 0 C-N-CA 125.679 1.592 . . . . 0.0 113.788 175.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 119.373 -0.346 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -61.11 -30.63 70.47 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.41 0.684 . . . . 0.0 112.234 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.1 m -73.78 -38.29 64.71 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.375 0.67 . . . . 0.0 111.39 173.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -82.07 -24.22 35.37 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.667 -175.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.2 mm -52.49 -48.66 89.28 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 120.504 1.502 . . . . 0.0 111.79 177.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.4 -37.59 22.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 CA-C-N 121.484 1.566 . . . . 0.0 113.342 172.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.05 -37.02 84.78 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.671 -1.268 . . . . 0.0 113.292 -175.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.14 -22.19 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.7 mt -81.09 -50.95 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.562 0.745 . . . . 0.0 110.116 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -59.54 -39.61 84.52 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.08 0.952 . . . . 0.0 112.008 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.75 -30.33 70.52 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 122.952 0.501 . . . . 0.0 111.373 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.68 -46.89 28.74 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 174.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -29.97 68.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 121.094 1.77 . . . . 0.0 114.145 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.88 -34.52 60.0 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -132.04 78.08 70.1 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.506 1.123 . . . . 0.0 111.932 171.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -54.58 -12.57 4.49 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.844 3.696 . . . . 0.0 117.462 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.32 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.229 1.412 . . . . 0.0 112.817 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -66.07 159.5 25.91 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 113.1 -171.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -84.13 138.84 32.81 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.636 -0.665 . . . . 0.0 109.389 169.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.22 -34.33 66.21 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 172.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -85.36 -29.66 24.28 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 115.558 1.688 . . . . 0.0 115.558 -173.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.7 t -64.28 -12.48 41.94 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.11 -0.994 . . . . 0.0 112.078 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -66.34 -3.69 6.46 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 119.662 -1.899 . . . . 0.0 113.737 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 -30.55 32.94 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.431 1.492 . . . . 0.0 111.955 167.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -66.68 -28.52 68.52 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.11 1.364 . . . . 0.0 112.074 -173.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.05 -30.01 55.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 114.79 173.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -166.63 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.496 -0.764 . . . . 0.0 112.968 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 11.6 t 103.98 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 129.552 3.141 . . . . 0.0 114.343 169.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -33.7 71.84 Favored 'General case' 0 CA--C 1.554 1.099 0 O-C-N 120.522 -1.361 . . . . 0.0 110.711 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -41.25 74.95 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.104 2.162 . . . . 0.0 113.454 173.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.77 8.16 39.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.066 1.347 . . . . 0.0 113.297 -174.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.0 ttm -62.59 123.08 17.43 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 109.904 172.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -77.78 155.34 31.2 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.041 -1.037 . . . . 0.0 110.494 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.84 -32.84 74.14 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.274 -1.516 . . . . 0.0 112.984 -174.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.85 -31.65 72.9 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.871 0.76 . . . . 0.0 112.871 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -80.18 -36.63 34.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.306 1.443 . . . . 0.0 111.357 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -61.45 -48.55 80.64 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.784 0.834 . . . . 0.0 112.611 175.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.45 -1.43 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 123.73 0.812 . . . . 0.0 113.163 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -110.56 -9.29 14.56 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.38 1.872 . . . . 0.0 114.076 172.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 155.72 40.08 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 119.875 1.216 . . . . 0.0 110.702 174.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -67.75 130.84 92.84 Favored Pre-proline 0 N--CA 1.479 0.982 0 O-C-N 121.292 -0.88 . . . . 0.0 110.624 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -46.58 -35.06 16.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.193 3.262 . . . . 0.0 114.117 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.429 ' HG2' ' H ' ' A' ' 4' ' ' SER . 59.3 mttt -60.39 -14.8 20.85 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -132.92 19.01 4.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.891 1.678 . . . . 0.0 112.609 166.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.1 ttm -70.0 -52.01 27.68 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.802 1.241 . . . . 0.0 110.88 169.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 2.7 m -45.76 -56.62 9.63 Favored Pre-proline 0 N--CA 1.489 1.519 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.88 -43.29 58.49 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.052 3.168 . . . . 0.0 115.389 175.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.39 -38.3 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.184 1.356 . . . . 0.0 112.724 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.04 -26.99 68.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.99 0.916 . . . . 0.0 111.042 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.507 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.7 t90 -84.01 -52.87 5.97 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.294 168.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.507 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.8 t90 -64.33 -31.18 72.28 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 120.048 1.295 . . . . 0.0 112.683 -166.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -61.61 -49.31 77.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.592 1.157 . . . . 0.0 111.406 172.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.548 0.866 0 C-N-CA 125.492 1.517 . . . . 0.0 111.802 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 . . . . . 0 N--CA 1.47 0.549 0 CA-C-O 119.458 -0.306 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.72 -23.13 65.94 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -82.96 -33.26 26.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 119.284 -0.388 . . . . 0.0 112.021 172.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.64 -27.38 29.16 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.01 -42.43 85.29 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 120.599 1.545 . . . . 0.0 113.495 176.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.39 -35.07 5.23 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 CA-C-N 122.438 1.906 . . . . 0.0 113.476 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -66.69 -32.12 73.23 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.261 -1.525 . . . . 0.0 113.42 -176.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.26 -29.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.721 -0.612 . . . . 0.0 112.122 172.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -71.26 -49.42 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.47 0.708 . . . . 0.0 110.151 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -57.56 -41.69 81.52 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.426 0.69 . . . . 0.0 111.995 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -67.94 -34.67 77.04 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 118.986 0.812 . . . . 0.0 112.295 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.14 -44.62 68.48 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.263 -0.898 . . . . 0.0 112.413 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -29.29 65.35 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.446 1.475 . . . . 0.0 114.865 179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -76.38 -27.44 56.39 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 170.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -132.97 73.05 76.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.019 1.328 . . . . 0.0 111.636 172.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -59.22 -11.57 13.53 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.037 3.158 . . . . 0.0 116.279 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -81.37 -23.19 37.85 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.78 1.632 . . . . 0.0 113.916 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -65.33 157.54 28.87 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.831 1.252 . . . . 0.0 111.279 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -96.07 133.61 40.12 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 118.322 -0.847 . . . . 0.0 109.289 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.8 tp -50.62 -38.52 46.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -168.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.273 4.8 m-85 -82.33 -1.02 48.36 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -177.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 62.4 p -64.99 -32.15 73.73 Favored 'General case' 0 N--CA 1.483 1.214 0 O-C-N 120.582 -1.324 . . . . 0.0 110.925 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -69.73 -1.87 10.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.415 1.486 . . . . 0.0 113.649 -176.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -77.7 -38.7 46.82 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.84 1.656 . . . . 0.0 112.244 167.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -27.62 64.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -167.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -70.28 -29.2 65.9 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.018 1.727 . . . . 0.0 114.581 170.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -167.959 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.8 t -99.37 92.69 5.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.699 1.2 . . . . 0.0 113.073 -165.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.13 -31.28 67.03 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.524 -1.36 . . . . 0.0 111.359 176.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.2 ptpt -74.52 -10.2 59.32 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 177.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -121.03 14.78 11.52 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.049 1.339 . . . . 0.0 111.821 168.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.42 118.95 7.62 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.855 -1.153 . . . . 0.0 108.016 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -76.53 154.87 34.18 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.176 -0.953 . . . . 0.0 109.672 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.15 -32.64 74.07 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.455 -1.403 . . . . 0.0 113.197 -172.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -62.82 -33.77 75.91 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 170.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -77.12 -37.16 54.67 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.071 1.349 . . . . 0.0 111.361 175.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -60.0 -50.15 74.88 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 121.469 -0.769 . . . . 0.0 112.353 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.8 pt -69.41 -2.84 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 124.561 1.144 . . . . 0.0 112.981 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -106.02 -12.11 15.91 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.249 1.42 . . . . 0.0 113.738 172.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.59 165.87 23.85 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.119 0.968 . . . . 0.0 110.474 170.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.509 HD21 ' HD3' ' A' ' 19' ' ' LYS . 48.8 t-20 -72.34 131.98 84.43 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.786 -1.196 . . . . 0.0 111.74 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.1 -30.67 41.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.229 3.286 . . . . 0.0 116.077 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.509 ' HD3' HD21 ' A' ' 17' ' ' ASN . 8.2 mttt -51.5 -59.28 4.43 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.456 1.902 . . . . 0.0 108.893 169.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 178.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 78.0 mtp -61.85 -35.38 78.1 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.065 1.302 . . . . 0.0 111.343 169.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 28.2 m -64.38 -54.15 40.36 Favored Pre-proline 0 N--CA 1.48 1.048 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -175.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -52.46 -39.04 75.11 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 123.493 2.796 . . . . 0.0 116.094 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.8 p -78.03 -34.56 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.61 1.095 . . . . 0.0 113.491 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -24.67 67.93 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.334 1.053 . . . . 0.0 110.62 172.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.516 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 68.7 t90 -85.74 -56.46 3.48 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 117.939 -1.029 . . . . 0.0 112.612 168.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.6 t90 -64.88 -28.99 69.92 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 120.655 1.571 . . . . 0.0 112.759 -166.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -61.42 -52.12 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.338 1.055 . . . . 0.0 111.357 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.548 0.903 0 C-N-CA 125.839 1.656 . . . . 0.0 111.955 -175.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 120.139 0.019 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.2 mt -65.11 -24.01 67.31 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.778 -0.576 . . . . 0.0 112.541 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.9 m -80.01 -33.4 39.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.922 1.289 . . . . 0.0 111.319 172.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.4 mm100 -82.64 -30.33 29.44 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.729 1.149 . . . . 0.0 113.249 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.7 -41.84 85.98 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 120.277 1.399 . . . . 0.0 113.423 175.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.1 -36.58 7.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 122.392 1.89 . . . . 0.0 113.429 169.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -66.17 -35.15 79.7 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.778 1.626 . . . . 0.0 113.817 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.03 -17.45 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 174.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -88.68 -52.09 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.255 1.022 . . . . 0.0 110.904 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.91 -42.17 71.88 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.082 0.953 . . . . 0.0 110.947 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.15 -30.7 70.76 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.049 -0.407 . . . . 0.0 111.403 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.9 m -74.68 -45.12 46.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.101 -0.952 . . . . 0.0 113.199 174.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.8 69.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 120.883 1.674 . . . . 0.0 114.166 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -82.2 -26.55 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -130.75 75.02 79.42 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 125.606 1.563 . . . . 0.0 110.912 170.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -60.75 -11.28 16.95 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.799 3.666 . . . . 0.0 115.871 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -80.28 -25.37 39.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.832 1.653 . . . . 0.0 112.782 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -69.96 160.51 31.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.43 1.492 . . . . 0.0 111.955 -172.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.62 146.92 26.64 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.561 -0.712 . . . . 0.0 110.058 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 57.1 tp -61.97 -31.63 72.0 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.263 -0.898 . . . . 0.0 113.219 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 2.4 m-85 -89.62 -24.87 21.56 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 -171.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -63.02 -15.43 56.43 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.863 -1.148 . . . . 0.0 112.071 171.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -66.26 -5.89 11.95 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.513 -1.992 . . . . 0.0 113.743 169.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -34.51 60.57 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.44 1.496 . . . . 0.0 111.606 167.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -62.96 -25.13 68.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.176 1.79 . . . . 0.0 112.774 -170.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -85.08 -30.89 23.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.423 1.889 . . . . 0.0 115.955 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.572 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 -166.245 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.258 50.1 mm-40 . . . . . 0 CA--C 1.545 0.782 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 101.42 93.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 131.14 3.776 . . . . 0.0 115.008 169.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.14 -34.17 69.97 Favored 'General case' 0 CA--C 1.555 1.136 0 O-C-N 120.383 -1.448 . . . . 0.0 110.641 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.452 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 15.5 mtmt -58.4 -34.75 71.09 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.3 1.84 . . . . 0.0 114.538 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -105.44 8.73 33.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.914 1.285 . . . . 0.0 112.976 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.9 ttm -62.38 123.79 19.2 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.635 1.107 . . . . 0.0 109.662 171.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -76.32 154.7 34.83 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 121.015 -1.053 . . . . 0.0 110.307 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.38 -31.95 73.24 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.162 -1.586 . . . . 0.0 113.187 -173.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -65.29 -32.49 74.17 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.155 0.889 . . . . 0.0 112.933 172.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -77.85 -37.35 48.58 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.303 1.441 . . . . 0.0 111.298 176.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -62.83 -47.69 82.33 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.547 -0.72 . . . . 0.0 112.75 176.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -69.76 -3.53 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -104.49 -10.61 17.54 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.043 1.737 . . . . 0.0 114.251 170.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.69 160.42 32.66 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 119.895 1.225 . . . . 0.0 110.895 173.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 50.3 t-20 -65.72 129.96 94.43 Favored Pre-proline 0 N--CA 1.48 1.062 0 O-C-N 121.118 -0.989 . . . . 0.0 111.571 -178.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 31.9 Cg_exo -60.43 -17.38 47.39 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.278 2.652 . . . . 0.0 114.783 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 mptt -54.69 -69.39 0.13 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.501 1.52 . . . . 0.0 109.889 168.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . 0.427 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -78.87 -11.53 60.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -175.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -54.58 -35.5 63.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 120.618 -1.302 . . . . 0.0 112.532 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 32.4 m -61.87 -57.8 21.93 Favored Pre-proline 0 N--CA 1.483 1.208 0 CA-C-O 117.719 -1.134 . . . . 0.0 113.542 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -53.95 -37.1 85.68 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.97 3.114 . . . . 0.0 114.244 169.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 99' ' ' ALA . 55.9 t -62.71 -50.14 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.562 -0.711 . . . . 0.0 111.534 174.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.11 -40.28 95.87 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.185 0.994 . . . . 0.0 109.897 -176.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.489 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 75.1 t90 -68.36 -49.65 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 116.991 -1.481 . . . . 0.0 112.592 172.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.85 -26.41 65.13 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 121.416 1.916 . . . . 0.0 111.268 -170.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -63.29 -48.83 76.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.385 1.074 . . . . 0.0 111.045 169.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.791 0 C-N-CA 124.865 1.266 . . . . 0.0 112.172 -179.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -59.31 -30.43 68.33 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.767 0.827 . . . . 0.0 112.423 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 86.8 m -78.75 -36.89 42.45 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.426 1.09 . . . . 0.0 111.625 174.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -78.66 -32.65 47.28 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.947 -1.095 . . . . 0.0 113.741 -176.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.41 -45.24 95.26 Favored Pre-proline 0 N--CA 1.481 1.087 0 CA-C-N 120.364 1.438 . . . . 0.0 113.09 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.69 -34.99 8.31 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 122.228 1.831 . . . . 0.0 113.277 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -66.19 -32.78 74.42 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.329 -1.482 . . . . 0.0 113.983 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 23.0 m -71.59 -27.19 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 121.798 -0.564 . . . . 0.0 111.878 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -72.3 -47.29 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.463 0.705 . . . . 0.0 110.131 170.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -57.88 -41.06 81.73 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.697 0.799 . . . . 0.0 112.075 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.73 -32.35 74.0 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.279 0.945 . . . . 0.0 112.263 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.37 -47.4 56.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.876 -1.14 . . . . 0.0 112.428 176.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.85 -29.02 66.17 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 120.555 1.525 . . . . 0.0 114.804 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -74.41 -28.53 61.11 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 170.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -134.21 73.91 68.63 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.073 1.349 . . . . 0.0 111.71 173.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -59.93 -11.11 14.02 Favored 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 124.018 3.145 . . . . 0.0 116.033 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -81.0 -22.63 39.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.929 1.692 . . . . 0.0 114.175 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -63.89 155.47 30.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.237 1.415 . . . . 0.0 111.085 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -91.33 133.73 35.19 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.8 tp -51.07 -39.01 55.05 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -168.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.452 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.7 m-85 -81.43 -5.54 58.01 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -176.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 77.0 p -59.22 -27.44 65.75 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.378 -1.451 . . . . 0.0 111.163 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -72.48 -2.48 19.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.209 1.404 . . . . 0.0 113.666 177.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -80.31 -32.06 38.06 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.747 1.158 . . . . 0.0 111.748 167.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -64.34 -26.62 68.56 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.201 1.0 . . . . 0.0 112.738 -169.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -77.01 -27.76 54.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.385 2.274 . . . . 0.0 116.149 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -166.09 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.995 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.7 t 98.59 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 128.72 2.808 . . . . 0.0 117.361 164.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.9 -34.89 73.78 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 119.88 -1.763 . . . . 0.0 112.091 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -72.12 -4.42 28.93 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 175.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.65 5.15 11.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.501 1.52 . . . . 0.0 112.445 169.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.3 ttm -62.56 125.67 24.73 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.641 -1.287 . . . . 0.0 109.54 175.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.71 154.79 29.8 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.402 -0.811 . . . . 0.0 110.496 179.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.03 -34.11 75.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.413 -1.429 . . . . 0.0 113.083 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.49 -31.86 73.15 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.715 0.806 . . . . 0.0 112.871 172.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -78.44 -38.13 42.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.958 1.303 . . . . 0.0 111.697 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -58.81 -50.03 75.47 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.533 0.733 . . . . 0.0 112.452 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.0 pt -67.86 -7.18 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.43 1.092 . . . . 0.0 112.98 177.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.51 -7.95 17.28 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.85 1.66 . . . . 0.0 113.607 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.23 159.29 32.7 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 110.702 175.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 51.9 t-20 -64.93 128.87 94.16 Favored Pre-proline 0 N--CA 1.483 1.184 0 O-C-N 121.222 -0.924 . . . . 0.0 112.088 -173.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 31.2 Cg_exo -56.91 -16.58 20.82 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.838 3.026 . . . . 0.0 115.247 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -61.71 -69.71 0.23 Allowed 'General case' 0 C--N 1.348 0.524 0 C-N-CA 125.819 1.648 . . . . 0.0 110.15 167.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.28 -3.12 48.09 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.5 ttt -58.91 -36.65 75.07 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 169.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -65.43 -51.5 51.55 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.422 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 5.8 Cg_endo -51.55 -47.71 24.87 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.048 2.499 . . . . 0.0 114.904 169.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 p -67.36 -37.53 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.788 -1.195 . . . . 0.0 113.162 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.46 -17.34 63.74 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.158 0.983 . . . . 0.0 112.854 175.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.467 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.7 t90 -97.97 -45.24 6.35 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.922 1.237 . . . . 0.0 111.814 168.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 31.5 t-105 -59.33 -34.29 72.16 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.108 0.963 . . . . 0.0 111.456 -172.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -74.13 -51.6 15.13 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.453 169.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 tm? . . . . . 0 CA--C 1.534 0.364 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -168.116 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 . . . . . 0 CA--C 1.536 0.413 0 CA-C-O 119.631 -0.223 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.52 -27.42 69.14 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.806 -1.184 . . . . 0.0 112.185 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 90.8 m -76.06 -36.79 58.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.569 0.747 . . . . 0.0 111.45 170.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -84.56 -27.6 27.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -176.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.25 -42.17 85.2 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 120.235 1.38 . . . . 0.0 112.918 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.47 -37.46 5.56 Favored 'Trans proline' 0 C--N 1.352 0.756 0 CA-C-N 122.145 1.802 . . . . 0.0 113.02 169.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -67.84 -33.09 74.09 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.226 -1.546 . . . . 0.0 113.76 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.6 m -68.21 -17.27 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.908 0.776 . . . . 0.0 113.083 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -87.43 -52.1 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.72 1.208 . . . . 0.0 110.186 172.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -56.67 -40.33 75.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.423 1.089 . . . . 0.0 111.838 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -71.96 -24.88 61.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.552 -0.717 . . . . 0.0 111.12 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.95 -43.69 21.63 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.318 -0.864 . . . . 0.0 112.193 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -27.78 69.53 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 120.444 1.475 . . . . 0.0 113.586 172.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -71.59 -37.7 70.96 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 169.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -125.22 63.53 42.64 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.001 1.32 . . . . 0.0 111.353 -176.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.17 -13.48 16.07 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.189 3.259 . . . . 0.0 115.905 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -86.1 -21.12 27.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.765 1.626 . . . . 0.0 113.581 -178.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -70.26 160.18 32.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.933 0.893 . . . . 0.0 112.008 -172.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.58 132.05 39.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -50.03 -36.61 29.53 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.437 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.5 m-85 -80.52 -9.33 59.77 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.795 -1.19 . . . . 0.0 114.06 -176.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -60.68 -26.83 67.39 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.646 -1.284 . . . . 0.0 111.348 168.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -71.88 -2.47 18.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.348 1.459 . . . . 0.0 114.274 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 -31.77 24.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.815 1.189 . . . . 0.0 111.678 168.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.78 -28.11 63.4 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.889 1.276 . . . . 0.0 111.87 -171.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -69.98 -30.19 67.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.75 1.22 . . . . 0.0 114.008 171.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -167.954 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 . . . . . 0 N--CA 1.471 0.623 0 CA-C-O 117.829 -1.081 . . . . 0.0 113.088 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 61.1 m 107.51 84.06 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 129.857 3.263 . . . . 0.0 115.761 167.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.29 69.16 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.243 -1.536 . . . . 0.0 111.751 175.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.453 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 8.3 ptpt -77.7 3.03 15.02 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 175.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -125.9 7.97 7.42 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.942 1.297 . . . . 0.0 112.194 169.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 34.5 ttm -62.71 125.04 22.6 Favored 'General case' 0 C--N 1.346 0.457 0 O-C-N 121.048 -1.032 . . . . 0.0 109.597 176.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.4 t -77.63 153.15 33.44 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.81 -0.556 . . . . 0.0 110.1 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.05 -30.62 71.68 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 120.475 -1.391 . . . . 0.0 112.978 -173.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -64.67 -31.67 73.0 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.857 0.753 . . . . 0.0 112.847 170.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -78.53 -38.39 40.65 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.854 1.261 . . . . 0.0 111.414 174.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -59.7 -48.15 82.83 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 121.541 -0.724 . . . . 0.0 112.728 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.57 -2.28 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.961 0.904 . . . . 0.0 113.116 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -109.31 -12.68 14.73 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.282 1.833 . . . . 0.0 114.112 173.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 157.78 35.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.944 1.247 . . . . 0.0 111.032 172.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.403 HD21 ' HD2' ' B' ' 98' ' ' LYS . 51.9 t-20 -66.59 130.21 94.1 Favored Pre-proline 0 N--CA 1.483 1.178 0 O-C-N 121.462 -0.774 . . . . 0.0 111.614 -175.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.82 -18.3 33.75 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.562 2.841 . . . . 0.0 115.188 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . 0.403 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.8 mttt -58.5 -68.69 0.23 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.07 1.748 . . . . 0.0 109.512 167.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.31 -2.49 49.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -177.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.9 ttm -61.92 -36.99 82.98 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 120.71 -1.243 . . . . 0.0 111.811 168.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 49.8 m -63.88 -52.26 58.38 Favored Pre-proline 0 N--CA 1.483 1.202 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.827 -177.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . 0.405 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 3.1 Cg_exo -47.8 -49.56 13.4 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 124.303 3.335 . . . . 0.0 114.932 169.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.91 -33.9 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 119.201 0.909 . . . . 0.0 113.205 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -25.13 67.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.807 0.843 . . . . 0.0 112.007 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 70.2 t90 -83.55 -55.85 4.06 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.078 165.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.4 t90 -62.62 -34.45 77.05 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 117.534 -1.666 . . . . 0.0 114.108 -162.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -64.74 -43.29 93.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.15 0.98 . . . . 0.0 111.601 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.545 0.755 0 C-N-CA 126.209 1.804 . . . . 0.0 111.739 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 N--CA 1.471 0.586 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -57.48 -29.49 64.31 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.615 0.766 . . . . 0.0 112.476 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.9 m -81.21 -36.1 30.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.475 1.11 . . . . 0.0 112.161 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.48 -29.39 28.03 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.88 -41.34 78.48 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 120.163 1.347 . . . . 0.0 113.365 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -74.15 -36.43 3.33 Favored 'Trans proline' 0 C--N 1.354 0.86 0 CA-C-N 122.257 1.842 . . . . 0.0 113.613 169.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -66.81 -30.44 70.63 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.398 -1.439 . . . . 0.0 114.092 -175.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.4 m -69.09 -22.19 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 28.3 mt -79.2 -50.98 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.258 1.023 . . . . 0.0 109.581 170.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -59.05 -38.55 79.64 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.11 -29.98 68.17 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.002 0.819 . . . . 0.0 112.227 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.88 -47.58 44.77 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.168 -0.957 . . . . 0.0 112.505 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -28.27 67.49 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 120.333 1.424 . . . . 0.0 114.472 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -77.29 -24.68 50.93 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.051 1.501 . . . . 0.0 115.051 171.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -135.08 72.79 66.69 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.807 1.243 . . . . 0.0 111.892 172.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.76 -12.16 17.16 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.804 3.003 . . . . 0.0 117.182 -173.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.71 -20.6 39.08 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.6 1.16 . . . . 0.0 113.486 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 52.0 mmtt -65.8 157.55 30.06 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.845 0.858 . . . . 0.0 112.135 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 28.2 t30 -93.07 131.47 38.06 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.2 tp -47.66 -39.02 16.15 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.385 1.474 . . . . 0.0 114.685 -172.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.453 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.4 m-85 -79.72 -8.79 59.45 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 68.4 p -60.46 -26.7 66.97 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 120.596 -1.315 . . . . 0.0 110.976 167.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -73.41 -2.22 21.47 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.18 1.392 . . . . 0.0 113.53 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -81.72 -32.87 31.39 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.688 1.131 . . . . 0.0 111.783 167.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -67.27 -31.12 71.22 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.539 1.136 . . . . 0.0 112.269 -169.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -70.38 -28.05 64.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.592 1.957 . . . . 0.0 115.502 172.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 115.596 1.702 . . . . 0.0 115.596 -166.434 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 N--CA 1.445 -0.699 0 N-CA-C 102.929 -2.989 . . . . 0.0 102.929 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.6 m -94.77 89.58 5.75 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 124.562 1.145 . . . . 0.0 112.345 -163.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.17 65.34 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 120.008 1.277 . . . . 0.0 111.014 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.2 mtmt -62.96 -20.72 65.52 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 127.16 2.184 . . . . 0.0 115.018 175.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -121.67 16.2 11.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.774 1.63 . . . . 0.0 111.778 177.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.3 ttm -61.77 117.73 6.23 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.53 155.04 36.48 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.162 -0.961 . . . . 0.0 109.499 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.18 -32.81 74.3 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.303 -1.498 . . . . 0.0 112.787 -172.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -62.84 -35.2 79.16 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 170.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -75.41 -37.88 60.21 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.826 1.251 . . . . 0.0 111.479 174.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -60.18 -50.69 72.67 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.531 -0.731 . . . . 0.0 112.241 177.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.5 pt -69.52 -1.19 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.547 1.139 . . . . 0.0 112.958 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -110.85 -10.87 14.41 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.728 1.611 . . . . 0.0 113.972 173.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 164.92 22.4 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.962 -1.086 . . . . 0.0 110.255 169.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.77 128.04 93.19 Favored Pre-proline 0 CA--C 1.556 1.196 0 O-C-N 120.84 -1.162 . . . . 0.0 112.219 -176.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -61.3 -7.26 8.06 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.788 3.658 . . . . 0.0 116.24 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 5.9 mptt -71.56 -59.29 2.83 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 127.072 2.149 . . . . 0.0 109.056 165.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.13 0.22 54.09 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 82.1 mtp -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 120.84 -1.162 . . . . 0.0 112.364 169.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.7 m -65.63 -51.18 51.82 Favored Pre-proline 0 N--CA 1.483 1.189 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.05 -45.62 39.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.179 2.586 . . . . 0.0 114.932 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.7 p -71.64 -31.88 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.605 -1.31 . . . . 0.0 113.419 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.1 -24.16 67.59 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.742 0.817 . . . . 0.0 111.485 171.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.439 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 74.0 t90 -85.09 -53.43 5.28 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.263 167.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.424 ' CH2' ' HB3' ' B' ' 105' ' ' TRP . 0.1 OUTLIER -52.94 -34.48 55.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.075 0.94 . . . . 0.0 112.62 -172.679 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -69.62 -49.14 56.69 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.676 1.19 . . . . 0.0 112.259 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.679 0 C-N-CA 125.79 1.636 . . . . 0.0 111.813 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.29 -24.99 67.85 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.08 0.952 . . . . 0.0 112.211 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.8 m -79.83 -32.19 40.6 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.46 1.104 . . . . 0.0 111.627 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -87.4 -28.7 21.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.577 1.08 . . . . 0.0 113.579 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.39 -41.97 79.27 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.185 173.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.41 -36.51 6.78 Favored 'Trans proline' 0 C--N 1.355 0.91 0 CA-C-N 122.382 1.886 . . . . 0.0 113.357 169.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -65.96 -35.62 81.08 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 120.317 -1.489 . . . . 0.0 113.565 -177.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.23 -21.43 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 174.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.6 mt -82.72 -51.37 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.901 0.88 . . . . 0.0 110.555 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.97 -43.21 73.3 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.043 0.937 . . . . 0.0 111.33 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -67.46 -30.05 69.67 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.918 -0.489 . . . . 0.0 111.732 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.5 m -74.41 -46.03 42.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.182 -0.913 . . . . 0.0 113.174 173.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -30.34 68.49 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.866 1.667 . . . . 0.0 114.453 177.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.252 20.4 pttt -79.21 -24.73 42.91 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 175.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -135.29 74.95 60.22 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 125.323 1.449 . . . . 0.0 112.522 169.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -59.53 -11.3 13.57 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.523 3.482 . . . . 0.0 117.176 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -80.15 -21.99 42.52 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.063 1.345 . . . . 0.0 113.369 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -69.43 159.22 33.63 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.861 1.264 . . . . 0.0 111.64 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.38 148.16 30.73 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.625 -0.672 . . . . 0.0 109.991 170.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.35 -33.55 75.76 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.27 -0.894 . . . . 0.0 112.666 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.422 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.7 m-85 -89.96 -24.66 21.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 117.007 2.225 . . . . 0.0 117.007 -169.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.8 t -60.0 -21.99 61.99 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.057 -1.027 . . . . 0.0 111.902 171.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -60.52 -7.44 2.14 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.944 -1.723 . . . . 0.0 113.709 171.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.7 tptt -66.9 -37.51 84.51 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.522 1.529 . . . . 0.0 112.258 167.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -29.88 71.03 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -167.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -85.29 -23.16 28.26 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.581 1.952 . . . . 0.0 115.848 -175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.775 0 N-CA-C 118.501 2.778 . . . . 0.0 118.501 -163.099 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.454 ' HB3' ' HE3' ' A' ' 19' ' ' LYS 0.25 52.9 mm-40 . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 72.7 m 108.0 84.47 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 130.595 3.558 . . . . 0.0 112.334 171.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.84 67.94 Favored 'General case' 0 CA--C 1.556 1.205 0 O-C-N 120.843 -1.161 . . . . 0.0 111.219 173.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.461 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 11.9 mtmt -63.42 -16.72 61.38 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 127.232 2.213 . . . . 0.0 116.601 173.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -121.2 9.32 10.43 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.866 1.266 . . . . 0.0 112.603 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.4 ttm -60.93 124.1 19.5 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.391 -0.818 . . . . 0.0 109.42 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -77.46 156.04 31.34 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.634 -0.667 . . . . 0.0 110.907 -177.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.41 -32.83 74.61 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.133 -1.604 . . . . 0.0 113.112 -173.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.78 -29.03 69.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.032 0.833 . . . . 0.0 112.611 171.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -84.25 -36.33 22.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.756 1.622 . . . . 0.0 111.313 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -62.26 -48.95 77.66 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.381 -0.824 . . . . 0.0 112.789 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.69 -6.3 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.816 0.847 . . . . 0.0 112.874 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.91 -11.57 15.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.314 1.846 . . . . 0.0 114.535 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.88 158.4 35.61 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.906 1.23 . . . . 0.0 110.845 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 96' ' ' ASN . . . . . 0.445 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 50.3 t-20 -66.38 131.03 94.22 Favored Pre-proline 0 N--CA 1.481 1.085 0 O-C-N 121.335 -0.853 . . . . 0.0 111.622 -176.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 97' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 35.4 Cg_exo -60.9 -18.68 58.46 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.125 2.55 . . . . 0.0 114.566 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -55.34 -67.82 0.25 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.183 1.393 . . . . 0.0 109.85 168.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.02 -4.58 57.07 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 31.4 ttm -59.88 -41.04 90.69 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.04 -1.038 . . . . 0.0 112.032 168.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 67.5 m -56.04 -54.9 47.32 Favored Pre-proline 0 N--CA 1.484 1.229 0 CA-C-O 117.97 -1.014 . . . . 0.0 113.45 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.74 -53.82 5.04 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.02 3.147 . . . . 0.0 113.699 171.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.6 -31.91 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 119.448 -2.032 . . . . 0.0 113.306 -176.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.96 73.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.186 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' TRP . . . . . 0.424 ' HB3' ' CH2' ' A' ' 27' ' ' TRP 0.288 0.0 OUTLIER -86.37 -39.23 16.63 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 116.487 -1.72 . . . . 0.0 112.322 176.261 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' TRP . . . . . 0.439 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.4 m0 -62.26 -22.13 65.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 122.419 2.372 . . . . 0.0 113.022 173.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -77.47 -57.84 3.6 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.981 0.912 . . . . 0.0 111.873 168.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 CA--C 1.546 0.81 0 C-N-CA 123.671 0.788 . . . . 0.0 112.271 -172.599 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 . . . . . 0 N--CA 1.467 0.389 0 N-CA-C 110.572 -0.159 . . . . 0.0 110.572 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 91.6 mt -57.14 -28.21 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.028 0.931 . . . . 0.0 112.389 173.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.5 m -80.8 -36.11 32.17 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.921 0.888 . . . . 0.0 112.013 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -81.95 -31.4 31.26 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.758 1.163 . . . . 0.0 114.058 -177.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.02 -39.68 72.62 Favored Pre-proline 0 CA--C 1.552 1.039 0 CA-C-N 120.07 1.305 . . . . 0.0 113.163 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -75.15 -36.37 2.51 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 122.388 1.889 . . . . 0.0 113.366 169.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -66.06 -29.74 70.14 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.395 -1.441 . . . . 0.0 113.908 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 32.3 m -69.38 -21.75 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 122.968 0.507 . . . . 0.0 112.327 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 10.3 mt -77.68 -50.7 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.327 1.051 . . . . 0.0 109.697 169.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.42 -39.57 87.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.293 0.637 . . . . 0.0 112.516 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.46 -27.46 65.24 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.019 0.827 . . . . 0.0 112.209 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.11 -50.11 20.93 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.453 -0.779 . . . . 0.0 112.319 175.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -27.32 68.4 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -79.05 -20.18 49.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 171.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -136.44 66.71 58.93 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.472 1.509 . . . . 0.0 110.52 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.23 -14.26 37.17 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 124.142 3.228 . . . . 0.0 116.494 -168.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.95 -24.72 48.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -62.62 157.96 19.42 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.937 1.295 . . . . 0.0 112.302 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -82.17 150.65 27.29 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.552 -0.717 . . . . 0.0 109.988 171.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.72 -41.18 99.04 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.293 -0.879 . . . . 0.0 113.15 176.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 146' ' ' TYR . . . . . 0.461 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.7 m-85 -82.41 -19.72 38.5 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -169.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 11.6 t -64.04 -15.01 58.5 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.793 -1.192 . . . . 0.0 112.197 169.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -67.87 -2.56 7.56 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 119.313 -2.117 . . . . 0.0 113.532 169.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -77.71 -30.81 51.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.69 1.132 . . . . 0.0 111.92 165.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -63.52 -33.38 75.45 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.919 1.288 . . . . 0.0 112.177 -169.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.94 -29.06 64.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.618 1.967 . . . . 0.0 115.346 170.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 125.408 1.483 . . . . 0.0 113.025 -168.412 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.25 51.7 t30 57.83 46.13 17.42 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.091 1.756 . . . . 0.0 114.918 176.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -62.74 -20.75 65.24 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.973 167.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.2 t 97.07 93.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 128.885 2.874 . . . . 0.0 117.422 165.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.53 -33.64 70.09 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 119.921 -1.737 . . . . 0.0 112.345 175.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 1.1 ptpt -73.85 -9.87 59.08 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 176.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -113.9 5.06 16.07 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.92 1.288 . . . . 0.0 112.468 168.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 29.0 ttm -60.57 127.31 31.08 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.957 1.253 . . . . 0.0 109.482 171.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -78.99 155.89 28.68 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.094 -1.004 . . . . 0.0 110.551 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.33 -35.75 78.26 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 120.338 -1.476 . . . . 0.0 112.801 -175.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.1 tp60 -61.69 -32.47 72.67 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.668 0.787 . . . . 0.0 113.014 172.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.5 tt0 -80.57 -36.84 32.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.115 1.366 . . . . 0.0 111.56 176.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -59.11 -48.57 81.13 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.532 -0.73 . . . . 0.0 112.327 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.2 pt -70.41 -2.04 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 124.318 1.047 . . . . 0.0 112.809 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -113.46 -15.08 12.66 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.973 1.709 . . . . 0.0 114.281 178.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.93 161.81 20.5 Favored 'General case' 0 CA--C 1.558 1.251 0 O-C-N 120.981 -1.074 . . . . 0.0 110.498 169.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.447 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 43.3 t-20 -63.92 132.53 95.28 Favored Pre-proline 0 N--CA 1.483 1.189 0 O-C-N 120.894 -1.129 . . . . 0.0 112.011 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 25.2 Cg_exo -62.22 -16.94 54.15 Favored 'Trans proline' 0 CA--C 1.541 0.855 0 C-N-CA 123.332 2.688 . . . . 0.0 114.831 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 mptt -57.87 -62.81 1.54 Allowed 'General case' 0 C--N 1.351 0.657 0 C-N-CA 125.218 1.407 . . . . 0.0 108.829 167.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.453 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -77.56 -10.48 59.52 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 89.0 mtp -60.21 -37.68 81.02 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 120.905 -1.122 . . . . 0.0 112.937 172.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.4 m -61.22 -52.09 73.68 Favored Pre-proline 0 N--CA 1.485 1.295 0 N-CA-C 114.56 1.318 . . . . 0.0 114.56 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.444 ' HB3' ' CG ' ' B' ' 106' ' ' TRP . 38.2 Cg_endo -59.7 -41.79 52.34 Favored 'Trans proline' 0 C--N 1.35 0.639 0 C-N-CA 122.772 2.315 . . . . 0.0 113.285 169.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 20' ' ' ALA . 87.9 t -56.73 -42.18 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 O-C-N 120.904 -1.123 . . . . 0.0 111.725 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.98 -48.17 82.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.821 0.848 . . . . 0.0 111.556 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.436 ' HB3' ' CH2' ' B' ' 106' ' ' TRP . 0.0 OUTLIER -76.14 -36.69 58.68 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 119.882 1.219 . . . . 0.0 111.351 179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.495 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -52.13 -41.95 62.95 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 119.976 1.262 . . . . 0.0 112.254 176.111 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.5 tmm? -72.98 -53.31 11.53 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.795 1.638 . . . . 0.0 111.805 176.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -66.88 -30.36 70.5 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.49 0.716 . . . . 0.0 112.237 -169.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -103.91 9.07 36.9 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.473 172.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 40.39 57.26 2.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 128.064 2.546 . . . . 0.0 114.799 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 52.58 17.91 0.89 Allowed 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 174.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.9 t -55.75 153.82 7.74 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -170.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.8 p -80.18 -9.0 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.124 1.37 . . . . 0.0 113.528 170.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 71.6 120.34 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.318 2.247 . . . . 0.0 114.687 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -118.52 157.67 26.85 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.639 1.576 . . . . 0.0 112.266 -173.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.62 -11.89 12.37 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 125.106 1.336 . . . . 0.0 115.291 -177.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 169.18 -161.46 35.06 Favored Glycine 0 CA--C 1.531 1.072 0 C-N-CA 126.738 2.113 . . . . 0.0 111.064 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -125.65 20.51 7.85 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.127 1.371 . . . . 0.0 113.911 178.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 m -75.95 58.4 1.16 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 126.502 1.921 . . . . 0.0 111.175 179.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.5 m -67.0 2.06 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 126.679 1.992 . . . . 0.0 114.452 -177.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.64 151.19 11.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.26 1.824 . . . . 0.0 112.21 172.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.9 mt -63.98 121.28 13.73 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.823 -0.548 . . . . 0.0 110.985 170.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -86.37 162.43 18.18 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.799 1.64 . . . . 0.0 109.943 174.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -66.81 -29.32 69.22 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.138 -1.601 . . . . 0.0 112.939 -175.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 4.0 m -60.26 -47.8 84.46 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.64 -49.24 78.3 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 123.499 0.719 . . . . 0.0 109.549 -178.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.2 mt -59.23 -34.6 72.4 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.563 1.145 . . . . 0.0 111.904 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 98.4 m -71.98 -36.2 69.74 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.762 0.825 . . . . 0.0 111.189 174.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -79.49 -24.86 42.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.519 -178.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.77 -46.1 98.53 Favored Pre-proline 0 N--CA 1.481 1.092 0 CA-C-N 120.824 1.647 . . . . 0.0 112.535 178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.25 -37.6 10.16 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.808 1.672 . . . . 0.0 113.3 170.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -66.08 -34.9 79.12 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.704 -1.247 . . . . 0.0 113.391 -176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.6 m -68.96 -17.17 21.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-N 118.965 0.802 . . . . 0.0 113.16 175.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 15.9 mt -88.42 -52.44 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 C-N-CA 124.369 1.068 . . . . 0.0 110.367 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -55.7 -47.82 76.17 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.292 1.037 . . . . 0.0 110.621 177.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -63.54 -25.24 68.16 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.43 -0.794 . . . . 0.0 112.106 -179.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.17 -49.03 13.21 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.484 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.01 68.62 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 120.961 1.71 . . . . 0.0 113.966 174.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -71.22 -28.32 64.11 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.843 1.657 . . . . 0.0 114.392 169.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 25.4 m-80 -135.37 66.57 65.89 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.982 1.313 . . . . 0.0 112.383 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -57.59 -15.68 21.28 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.591 2.861 . . . . 0.0 116.575 -173.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -82.6 -21.3 35.22 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.298 1.439 . . . . 0.0 113.523 -178.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -71.62 160.37 32.78 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.694 1.197 . . . . 0.0 111.933 -173.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -76.56 154.7 34.26 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.854 -0.529 . . . . 0.0 109.891 170.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.0 tp -70.18 -38.42 75.37 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.264 -0.898 . . . . 0.0 113.103 177.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 1.4 m-85 -82.58 -21.96 35.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.0 t -60.11 -20.76 59.86 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.377 -0.827 . . . . 0.0 111.961 173.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -62.03 -5.07 1.93 Allowed 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.586 -1.946 . . . . 0.0 114.074 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.04 -33.77 74.13 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 119.806 1.184 . . . . 0.0 111.518 165.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -62.13 -31.93 72.46 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -167.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -74.78 -28.01 60.56 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.774 1.63 . . . . 0.0 115.129 176.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -94.23 128.78 40.89 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -166.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.8 m -90.2 -24.83 20.9 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 115.237 1.569 . . . . 0.0 115.237 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 52.56 -96.29 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.611 1.564 . . . . 0.0 114.024 -173.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -168.75 -31.71 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.257 2.223 . . . . 0.0 112.101 -169.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.19 149.76 86.06 Favored Pre-proline 0 CA--C 1.56 1.344 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 -175.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -87.17 153.89 8.2 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.073 3.182 . . . . 0.0 113.554 178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 116.999 -1.477 . . . . 0.0 112.735 168.774 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.436 0.16 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.25 13.8 t-20 68.02 66.65 0.35 Allowed 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 124.612 2.149 . . . . 0.0 112.527 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -117.47 154.09 32.0 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 129.807 3.243 . . . . 0.0 103.69 167.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m -87.57 87.91 7.52 Favored 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 125.298 1.439 . . . . 0.0 113.285 -165.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.88 -38.57 56.59 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 120.383 1.447 . . . . 0.0 110.463 170.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -67.8 -7.03 24.28 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 127.686 2.394 . . . . 0.0 115.707 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -136.59 18.85 3.09 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.91 1.284 . . . . 0.0 112.482 174.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.9 ttm -59.48 120.92 10.28 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 168.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.0 t -73.77 153.79 39.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.107 -0.995 . . . . 0.0 109.552 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.71 -31.24 72.11 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.55 -1.344 . . . . 0.0 113.235 -172.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -65.84 -32.43 73.95 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.198 0.908 . . . . 0.0 113.121 171.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -76.5 -36.6 57.69 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.292 1.437 . . . . 0.0 111.115 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -63.79 -48.64 76.07 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.29 -0.881 . . . . 0.0 112.932 177.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.0 pt -69.63 -5.16 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.971 0 C-N-CA 123.345 0.658 . . . . 0.0 112.697 176.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -103.47 -15.46 15.87 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.221 1.808 . . . . 0.0 114.23 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.91 158.86 31.72 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.9 1.227 . . . . 0.0 110.581 171.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.408 HD21 ' HD2' ' B' ' 98' ' ' LYS . 49.7 t-20 -66.4 132.05 94.29 Favored Pre-proline 0 N--CA 1.481 1.092 0 O-C-N 121.416 -0.802 . . . . 0.0 111.6 -174.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_exo -56.95 -20.46 36.69 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.81 3.007 . . . . 0.0 115.379 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 96' ' ' ASN . 32.1 mttt -56.7 -64.12 0.98 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.996 1.719 . . . . 0.0 108.89 166.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.34 -12.15 59.1 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.0 ttm -57.02 -35.87 69.77 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 120.511 -1.368 . . . . 0.0 111.916 172.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.4 m -63.0 -54.92 42.25 Favored Pre-proline 0 N--CA 1.482 1.155 0 C-N-CA 124.319 1.047 . . . . 0.0 112.81 -177.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.419 ' HG2' HG22 ' A' ' 24' ' ' VAL . 1.5 Cg_endo -50.1 -45.94 30.74 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 123.5 2.8 . . . . 0.0 113.685 168.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 20.3 t -63.64 -38.51 82.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 119.003 0.82 . . . . 0.0 111.838 -179.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.84 -39.63 90.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.576 0.751 . . . . 0.0 111.297 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CG ' ' CH2' ' A' ' 27' ' ' TRP . 89.5 t90 -67.35 -46.79 72.35 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.59 1.086 . . . . 0.0 110.243 167.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.444 ' CG ' ' HB3' ' A' ' 23' ' ' PRO . 0.6 OUTLIER -58.34 -33.28 69.36 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 123.427 1.584 . . . . 0.0 113.073 -168.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.3 tmm? -76.05 -42.59 47.11 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.234 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.415 HD21 HG11 ' B' ' 133' ' ' VAL . 3.4 mm? -64.91 -22.82 67.06 Favored 'General case' 0 CA--C 1.55 0.954 0 O-C-N 120.849 -1.157 . . . . 0.0 114.063 171.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 -141.56 95.87 2.89 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 126.927 2.091 . . . . 0.0 109.267 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -60.25 169.34 1.65 Allowed 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 -174.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -63.1 2.14 0.38 Allowed 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 174.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.3 t -62.91 177.72 0.54 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.728 1.211 . . . . 0.0 112.474 169.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -109.58 153.53 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 125.498 1.519 . . . . 0.0 110.506 -178.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.33 168.49 18.96 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -169.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 26.8 mtmt -121.26 54.46 1.11 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.47 1.508 . . . . 0.0 113.538 -167.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.06 31.33 26.2 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 124.431 1.015 . . . . 0.0 115.063 169.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -156.76 -171.26 22.7 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.121 0.867 . . . . 0.0 114.473 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -126.55 10.92 7.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.964 1.306 . . . . 0.0 114.52 -173.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 33.5 p -72.69 13.8 0.33 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.3 m -62.93 -15.94 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 125.552 1.541 . . . . 0.0 113.494 171.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.43 161.75 1.82 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.791 1.236 . . . . 0.0 112.848 169.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 75.5 mt -74.38 71.31 1.76 Allowed 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 122.321 1.058 . . . . 0.0 108.616 166.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -64.71 166.85 8.18 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.342 2.257 . . . . 0.0 110.998 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.91 -26.28 65.91 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 120.486 -1.384 . . . . 0.0 113.998 -170.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.0 m -66.94 -47.89 70.25 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.313 -0.867 . . . . 0.0 110.476 169.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.84 -47.23 86.58 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.486 -0.759 . . . . 0.0 111.943 174.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.57 -30.06 64.94 Favored 'General case' 0 N--CA 1.474 0.729 0 O-C-N 121.183 -0.948 . . . . 0.0 112.706 175.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 68.0 m -80.39 -34.47 36.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.952 0.901 . . . . 0.0 111.949 174.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -79.63 -36.84 37.28 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 117.869 -1.062 . . . . 0.0 113.527 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -48.96 -46.3 74.68 Favored Pre-proline 0 N--CA 1.478 0.929 0 CA-C-N 120.238 1.381 . . . . 0.0 113.017 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.6 -38.21 6.24 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 CA-C-N 122.074 1.777 . . . . 0.0 113.448 171.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -64.81 -34.4 78.27 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.913 1.233 . . . . 0.0 113.367 -175.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . 0.415 HG11 HD21 ' B' ' 108' ' ' LEU . 20.8 m -75.48 -27.86 19.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.217 0.607 . . . . 0.0 112.575 177.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.9 mt -67.8 -47.24 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 169.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.09 -38.82 80.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.887 0.875 . . . . 0.0 112.316 174.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -65.49 -31.88 73.19 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.181 0.901 . . . . 0.0 112.149 177.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -72.14 -48.01 46.77 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.802 -1.186 . . . . 0.0 112.397 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.85 -29.4 68.54 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 120.181 1.355 . . . . 0.0 114.502 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -79.32 -22.08 45.04 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 171.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.47 64.89 66.12 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 126.66 1.984 . . . . 0.0 110.45 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -64.22 -11.49 28.11 Favored 'Trans proline' 0 C--N 1.354 0.834 0 C-N-CA 123.988 3.125 . . . . 0.0 115.881 -169.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -81.42 -21.26 39.02 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.705 1.202 . . . . 0.0 113.387 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 48.2 mmtt -68.03 159.03 31.6 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.838 0.855 . . . . 0.0 112.373 -173.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -83.9 127.91 34.18 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.7 tp -44.73 -38.86 4.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 177.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.03 -7.59 58.23 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 57.4 p -60.43 -30.15 69.45 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 120.579 -1.325 . . . . 0.0 111.125 167.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -69.54 -2.45 11.43 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.774 1.63 . . . . 0.0 113.533 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -38.38 53.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.159 0.983 . . . . 0.0 110.896 166.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -29.97 71.02 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -167.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -68.68 -27.78 66.28 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.661 1.984 . . . . 0.0 115.646 170.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -104.46 105.38 15.47 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.11 1.364 . . . . 0.0 114.214 -167.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 19.7 m -84.97 30.77 0.57 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 125.007 1.323 . . . . 0.0 114.253 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -83.55 -17.89 40.23 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -169.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -84.88 44.44 1.07 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -170.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -155.9 158.78 31.81 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.725 1.61 . . . . 0.0 111.596 172.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -65.78 155.0 71.46 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.715 2.277 . . . . 0.0 112.667 171.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.265 0 C-N-CA 125.665 1.586 . . . . 0.0 112.85 177.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.312 10.4 t-20 68.31 35.34 3.48 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -73.89 161.32 30.27 Favored 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 126.87 2.068 . . . . 0.0 106.847 163.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.0 t -102.75 92.93 4.82 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 124.895 1.278 . . . . 0.0 113.065 -165.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.58 68.45 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.418 -1.426 . . . . 0.0 111.329 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 5.6 ptpt -74.41 -7.22 52.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.241 1.816 . . . . 0.0 115.228 177.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -123.41 15.81 9.69 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.404 1.482 . . . . 0.0 111.95 168.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.1 ttm -61.86 118.63 7.46 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.829 -1.169 . . . . 0.0 108.446 171.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -76.64 155.35 33.51 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.059 -1.026 . . . . 0.0 109.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.84 -29.72 69.71 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 120.312 -1.492 . . . . 0.0 113.784 -169.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -40.74 96.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.114 0.87 . . . . 0.0 111.804 169.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -66.86 -37.02 83.65 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.152 0.981 . . . . 0.0 111.772 174.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -60.91 -52.99 62.68 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.39 -0.819 . . . . 0.0 112.299 177.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.04 -0.93 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.937 0 C-N-CA 125.103 1.361 . . . . 0.0 112.785 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -107.16 -15.59 14.63 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.427 1.491 . . . . 0.0 113.61 172.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.38 164.56 22.67 Favored 'General case' 0 CA--C 1.554 1.115 0 O-C-N 121.076 -1.015 . . . . 0.0 110.522 169.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.487 HD21 ' HD3' ' A' ' 19' ' ' LYS . 52.7 t-20 -71.73 131.37 86.05 Favored Pre-proline 0 N--CA 1.484 1.233 0 O-C-N 120.867 -1.145 . . . . 0.0 112.411 -176.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -56.11 -18.37 23.02 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.557 3.505 . . . . 0.0 116.299 175.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.487 ' HD3' HD21 ' A' ' 17' ' ' ASN . 10.9 mttt -60.36 -58.19 9.55 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 126.304 1.842 . . . . 0.0 109.212 167.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.46 -2.68 58.78 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 178.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 75.4 mtp -63.18 -36.65 84.33 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.43 -1.419 . . . . 0.0 111.509 169.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.7 m -59.81 -52.25 75.08 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 124.776 1.231 . . . . 0.0 113.362 -177.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -53.19 -58.58 1.38 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.165 2.576 . . . . 0.0 113.94 167.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.4 p -63.48 -25.26 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 CA-C-N 120.893 1.679 . . . . 0.0 113.294 -169.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.59 -25.37 67.94 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 118.124 -0.941 . . . . 0.0 113.21 171.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 62.6 t90 -84.03 -55.34 4.27 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.176 1.353 . . . . 0.0 114.303 178.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.451 ' CD1' ' HB3' ' B' ' 102' ' ' PRO . 4.7 m95 -51.68 -40.28 59.79 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.886 0.85 . . . . 0.0 110.888 -173.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -58.57 -49.38 77.65 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.941 1.697 . . . . 0.0 111.934 178.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.77 -19.81 64.37 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.976 1.311 . . . . 0.0 113.755 175.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -101.81 -1.4 32.37 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.65 1.352 . . . . 0.0 114.65 173.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 65.57 163.57 0.16 Allowed 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.193 2.197 . . . . 0.0 115.751 178.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -75.59 78.51 2.59 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.742 -1.224 . . . . 0.0 110.251 170.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -148.39 174.11 12.39 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.143 1.777 . . . . 0.0 111.105 -177.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.4 p -114.75 147.53 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.121 1.369 . . . . 0.0 109.351 169.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.07 151.84 45.94 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -174.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.76 53.7 1.89 Allowed 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.577 1.551 . . . . 0.0 113.606 -167.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.67 -10.25 62.59 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 125.733 1.635 . . . . 0.0 115.921 172.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -84.78 170.88 46.36 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 118.678 1.239 . . . . 0.0 113.601 172.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -121.53 9.28 10.22 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.524 1.53 . . . . 0.0 113.084 171.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 16.6 p -74.29 17.77 0.18 Allowed 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 126.299 1.84 . . . . 0.0 114.91 -173.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 3.1 m -62.78 -24.56 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.165 1.386 . . . . 0.0 112.93 169.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.456 HG23 HG23 ' B' ' 113' ' ' VAL . 0.1 OUTLIER -57.97 152.73 15.71 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.78 0.832 . . . . 0.0 111.848 170.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -76.36 79.55 3.11 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 123.062 1.41 . . . . 0.0 110.894 179.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -63.57 166.75 6.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.645 2.378 . . . . 0.0 110.571 168.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.05 -22.37 64.95 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.535 -1.353 . . . . 0.0 113.998 -171.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 53.8 m -66.73 -47.88 70.93 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.112 0.869 . . . . 0.0 110.45 170.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.16 -45.88 89.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 119.088 0.858 . . . . 0.0 111.554 173.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.9 mt -65.47 -28.38 69.17 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.179 -0.951 . . . . 0.0 112.127 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 96.8 m -74.47 -38.41 62.93 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.39 0.676 . . . . 0.0 111.06 172.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -83.17 -32.21 26.73 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.121 -1.419 . . . . 0.0 114.033 -175.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -46.64 -48.62 48.64 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-N 120.626 1.557 . . . . 0.0 112.77 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -66.1 -36.3 30.01 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.376 2.051 . . . . 0.0 113.949 172.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -64.11 -34.19 77.47 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.833 -1.167 . . . . 0.0 112.977 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -62.09 -30.4 48.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 118.61 0.641 . . . . 0.0 111.692 175.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 7.3 mt -78.62 -51.17 17.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 123.506 0.722 . . . . 0.0 110.585 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -60.49 -39.3 87.2 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 123.646 0.778 . . . . 0.0 112.075 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -68.73 -31.05 69.84 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.305 0.642 . . . . 0.0 111.293 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.4 m -73.43 -46.04 50.86 Favored 'General case' 0 N--CA 1.469 0.49 0 O-C-N 121.086 -1.009 . . . . 0.0 113.223 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.42 68.77 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-N 121.032 1.742 . . . . 0.0 114.235 178.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -76.88 -33.79 57.81 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 174.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -132.4 77.56 69.96 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.631 1.172 . . . . 0.0 112.019 172.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -54.13 -11.78 3.07 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 124.972 3.781 . . . . 0.0 117.255 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -27.23 56.75 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.22 1.408 . . . . 0.0 112.527 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.8 mmtt -65.97 157.51 30.61 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.798 1.239 . . . . 0.0 112.493 -174.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.4 t30 -93.05 133.89 35.74 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 169.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.6 tp -49.81 -32.87 15.06 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.448 1.499 . . . . 0.0 114.175 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.1 m-85 -82.8 -10.76 58.72 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.2 p -60.61 -25.79 66.53 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.698 -1.252 . . . . 0.0 111.573 169.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -72.73 -0.08 12.21 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.723 1.609 . . . . 0.0 113.944 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.36 -34.18 25.67 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.649 1.579 . . . . 0.0 111.48 167.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -70.18 -28.8 65.6 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.045 1.338 . . . . 0.0 111.933 -170.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -71.88 -30.28 65.24 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.49 1.516 . . . . 0.0 115.008 175.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -102.88 -35.14 8.71 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 116.56 2.059 . . . . 0.0 116.56 -166.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.0 m 62.62 -41.55 0.17 Allowed 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 127.523 2.329 . . . . 0.0 115.662 -169.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 22.6 t30 66.96 167.0 0.23 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 129.648 3.179 . . . . 0.0 116.318 175.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -72.34 22.39 0.06 Allowed 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 128.115 2.566 . . . . 0.0 116.945 -167.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.51 151.71 65.78 Favored Pre-proline 0 CA--C 1.55 0.945 0 O-C-N 120.703 -1.248 . . . . 0.0 112.389 172.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.2 161.73 44.89 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 122.894 2.396 . . . . 0.0 112.104 170.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.254 1.34 0 C-N-CA 125.451 1.501 . . . . 0.0 112.133 -176.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 49.8 t30 56.86 48.9 15.1 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.793 1.637 . . . . 0.0 113.927 178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -62.55 -20.02 64.24 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.084 0.954 . . . . 0.0 113.144 169.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 97.63 99.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 128.891 2.876 . . . . 0.0 116.156 168.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.33 -30.9 67.06 Favored 'General case' 0 CA--C 1.558 1.255 0 O-C-N 120.083 -1.636 . . . . 0.0 111.774 169.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -67.08 -17.85 65.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.085 1.754 . . . . 0.0 115.292 174.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -115.57 6.29 14.57 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.596 1.158 . . . . 0.0 113.175 177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.3 ttm -63.21 125.71 24.99 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.96 -1.087 . . . . 0.0 110.651 175.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -79.87 155.48 27.78 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.834 -1.166 . . . . 0.0 110.866 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.08 -35.36 78.43 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 120.116 -1.615 . . . . 0.0 112.862 -174.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.31 -29.42 70.5 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.182 0.901 . . . . 0.0 112.731 173.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 50.3 tt0 -82.45 -35.58 27.39 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.719 1.608 . . . . 0.0 111.386 176.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -63.35 -48.55 77.5 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.789 0.835 . . . . 0.0 112.727 175.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -67.75 -4.52 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.785 0.834 . . . . 0.0 112.854 176.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.28 -11.03 15.66 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.487 1.915 . . . . 0.0 114.404 172.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.04 158.26 36.01 Favored 'General case' 0 CA--C 1.551 1.019 0 O-C-N 120.653 -1.279 . . . . 0.0 110.83 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -65.41 129.98 94.55 Favored Pre-proline 0 N--CA 1.478 0.941 0 O-C-N 121.207 -0.933 . . . . 0.0 111.534 -178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.75 -18.08 53.78 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 122.935 2.423 . . . . 0.0 114.808 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -54.5 -66.95 0.31 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.217 1.407 . . . . 0.0 109.521 168.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.55 -9.84 59.69 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.8 ttm -56.26 -43.44 78.74 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.871 0.868 . . . . 0.0 112.581 171.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 86.6 m -55.85 -54.73 48.75 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.019 -0.991 . . . . 0.0 113.655 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 7.4 Cg_endo -54.4 -54.2 5.01 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 124.438 3.425 . . . . 0.0 114.073 169.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.8 p -63.13 -31.39 52.49 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 119.667 -1.896 . . . . 0.0 113.338 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.52 -30.27 71.16 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 117.685 -1.15 . . . . 0.0 111.399 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.407 ' HB3' ' CH2' ' A' ' 27' ' ' TRP . 0.0 OUTLIER -86.83 -41.1 14.32 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 116.402 -1.761 . . . . 0.0 111.593 175.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.421 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 6.2 m0 -59.74 -22.95 62.77 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 123.356 2.798 . . . . 0.0 113.659 171.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.9 tmm? -76.97 -63.99 1.23 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.43 0.692 . . . . 0.0 111.092 167.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.93 -32.82 74.53 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.639 1.176 . . . . 0.0 113.842 -168.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . 0.485 ' CG ' HD22 ' B' ' 154' ' ' ASN . 0.3 OUTLIER -116.71 -0.32 12.38 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.516 1.526 . . . . 0.0 112.982 -172.002 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 57.95 -1.3 0.08 Allowed 'General case' 0 CA--C 1.553 1.069 0 N-CA-C 118.579 2.807 . . . . 0.0 118.579 169.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 62.42 -67.9 0.07 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.485 1.914 . . . . 0.0 113.581 -171.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . 0.252 10.8 t 38.15 46.18 0.83 Allowed 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 127.311 2.244 . . . . 0.0 113.96 174.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . 0.456 HG23 HG23 ' A' ' 42' ' ' THR . 2.6 p 52.74 -1.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 129.701 3.201 . . . . 0.0 117.497 -178.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . 0.291 0.5 OUTLIER 58.69 43.3 18.98 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 127.308 2.243 . . . . 0.0 113.817 -170.77 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 46.6 pttt -38.6 123.91 1.27 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.86 2.064 . . . . 0.0 113.196 174.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 69.93 6.06 54.82 Favored Glycine 0 CA--C 1.54 1.616 0 N-CA-C 117.683 1.833 . . . . 0.0 117.683 171.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -146.69 -173.46 17.93 Favored Glycine 0 CA--C 1.536 1.352 0 CA-C-N 120.088 1.944 . . . . 0.0 114.942 -177.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -136.79 -4.69 1.98 Allowed 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 22.6 p -77.34 43.6 0.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.431 1.893 . . . . 0.0 114.781 -173.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 36.0 m -64.19 -16.94 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 125.27 1.428 . . . . 0.0 113.21 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.16 159.21 4.57 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.423 1.489 . . . . 0.0 111.684 168.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 75.9 mt -70.22 106.14 3.21 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.051 -1.031 . . . . 0.0 109.433 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -76.35 164.99 25.48 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.323 1.049 . . . . 0.0 109.464 173.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -64.26 -26.1 68.35 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 120.221 -1.549 . . . . 0.0 112.2 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 11.2 m -63.89 -44.06 94.16 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.617 -0.677 . . . . 0.0 110.957 169.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -62.72 -49.84 73.47 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.21 0.913 . . . . 0.0 111.003 175.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 92.0 mt -57.28 -28.35 62.92 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.523 0.729 . . . . 0.0 112.48 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 53.3 m -83.94 -34.69 24.41 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.607 1.163 . . . . 0.0 112.406 175.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.0 mm100 -84.67 -33.34 23.23 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 117.608 -1.187 . . . . 0.0 113.751 -176.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.33 -43.86 92.15 Favored Pre-proline 0 N--CA 1.481 1.11 0 CA-C-N 120.457 1.48 . . . . 0.0 112.871 177.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -69.46 -39.07 7.55 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 CA-C-N 122.389 1.889 . . . . 0.0 113.312 171.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -65.24 -33.91 77.1 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 119.776 1.171 . . . . 0.0 113.76 -174.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.32 -24.07 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.358 0.663 . . . . 0.0 112.355 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 27.5 mt -73.95 -49.78 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 123.607 0.763 . . . . 0.0 109.567 170.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -58.51 -41.56 85.7 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.957 0.903 . . . . 0.0 112.258 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.79 -26.16 65.96 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.167 -0.958 . . . . 0.0 112.302 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.2 -47.15 25.09 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.766 0.827 . . . . 0.0 112.215 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -26.86 68.14 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-N 120.268 1.394 . . . . 0.0 114.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.258 15.1 ptpt -84.13 -10.15 58.01 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -137.56 61.35 30.42 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 111.112 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -61.65 -14.16 34.19 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 123.877 3.051 . . . . 0.0 115.679 -168.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -85.57 -14.99 44.07 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.087 1.355 . . . . 0.0 113.657 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -74.43 158.5 33.76 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.199 0.999 . . . . 0.0 111.765 -172.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -92.86 133.7 35.81 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -50.23 -40.05 46.42 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.914 1.285 . . . . 0.0 114.272 -169.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.257 5.0 m-85 -79.2 -6.84 57.53 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.9 p -61.97 -27.12 68.63 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.694 -1.254 . . . . 0.0 111.176 168.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -72.58 -3.66 26.03 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.04 1.336 . . . . 0.0 113.943 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -81.38 -29.46 34.01 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 119.374 0.988 . . . . 0.0 112.036 167.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -68.97 -32.12 71.47 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.747 0.819 . . . . 0.0 112.049 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -69.67 -28.43 65.86 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.16 1.784 . . . . 0.0 115.376 169.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -108.09 106.48 16.72 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -165.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 22.9 t -91.87 96.85 10.62 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 167.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' B' ' 109' ' ' HIS . 36.0 t30 -84.04 -167.31 1.7 Allowed 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.369 1.067 . . . . 0.0 112.563 -171.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -63.95 -13.2 44.18 Favored 'General case' 0 CA--C 1.552 1.05 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -174.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.41 146.71 97.85 Favored Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 124.908 1.283 . . . . 0.0 114.435 -175.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -65.84 160.46 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.178 2.585 . . . . 0.0 113.328 169.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.501 1.12 . . . . 0.0 113.569 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 119.969 -0.062 . . . . 0.0 111.084 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -165.94 113.07 0.91 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 122.622 1.201 . . . . 0.0 108.611 167.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -166.28 -166.07 0.85 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.341 2.657 . . . . 0.0 106.439 -168.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.517 ' H ' ' HG2' ' B' ' 98' ' ' LYS . 15.0 m -134.48 56.76 1.83 Allowed 'General case' 0 C--O 1.218 -0.593 0 C-N-CA 123.675 0.79 . . . . 0.0 110.248 169.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -52.76 -40.97 63.6 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 121.273 1.851 . . . . 0.0 111.475 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.413 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 3.3 ptpt -64.53 -11.04 30.09 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 127.511 2.324 . . . . 0.0 116.172 175.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -133.28 21.0 4.02 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.036 1.735 . . . . 0.0 111.727 171.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.477 ' HE1' ' HB2' ' B' ' 99' ' ' ALA . 19.3 ttm -62.13 122.65 16.08 Favored 'General case' 0 C--N 1.353 0.746 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.6 t -76.96 153.97 34.05 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.08 -32.61 74.03 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 120.616 -1.302 . . . . 0.0 112.823 -173.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -62.96 -31.13 72.17 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.712 0.805 . . . . 0.0 112.971 170.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -80.73 -39.41 27.04 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.41 1.484 . . . . 0.0 111.851 176.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -58.71 -49.76 76.42 Favored 'General case' 0 N--CA 1.465 0.278 0 O-C-N 121.476 -0.765 . . . . 0.0 113.028 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -67.25 -4.44 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.965 0 C-N-CA 123.979 0.912 . . . . 0.0 112.668 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -112.94 -5.48 13.81 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.227 1.811 . . . . 0.0 113.813 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.424 HD22 ' HE1' ' A' ' 8' ' ' MET . 0.3 OUTLIER -75.81 161.98 28.55 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.897 -1.127 . . . . 0.0 110.382 173.618 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.439 HD21 ' HD3' ' A' ' 19' ' ' LYS . 45.2 t-20 -66.41 128.19 93.71 Favored Pre-proline 0 N--CA 1.487 1.421 0 O-C-N 120.899 -1.126 . . . . 0.0 111.611 -174.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.4 -20.81 16.32 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.339 3.359 . . . . 0.0 115.879 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HD3' HD21 ' A' ' 17' ' ' ASN . 5.4 mptt -59.86 -67.07 0.42 Allowed 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 126.181 1.792 . . . . 0.0 109.811 168.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.16 -5.29 57.53 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -177.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -60.79 -40.38 92.44 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.1 -1.0 . . . . 0.0 112.674 169.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.253 23.7 m -65.4 -52.11 47.79 Favored Pre-proline 0 N--CA 1.479 0.993 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -177.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -49.69 -42.85 42.19 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.558 2.839 . . . . 0.0 116.146 169.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.33 -37.44 38.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 119.913 1.233 . . . . 0.0 113.087 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.83 -28.62 68.95 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.781 0.832 . . . . 0.0 111.738 171.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.8 t90 -81.83 -53.77 5.91 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 117.693 -1.146 . . . . 0.0 112.406 170.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.43 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.0 t90 -64.12 -37.81 88.78 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 120.365 1.439 . . . . 0.0 111.281 -167.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.0 tmm? -59.08 -31.23 68.71 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.746 1.218 . . . . 0.0 112.615 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.04 -5.1 39.47 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -134.36 -35.8 0.91 Allowed 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 177.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 63.06 168.59 0.14 Allowed 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.457 1.903 . . . . 0.0 111.599 -165.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.34 35.69 0.15 Allowed 'General case' 0 N--CA 1.481 1.08 0 O-C-N 119.737 -1.852 . . . . 0.0 113.856 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.1 t -76.22 147.98 38.0 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.414 1.486 . . . . 0.0 112.702 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.8 t -78.9 133.97 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.858 0.863 . . . . 0.0 110.441 -178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -74.4 153.97 39.0 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.786 1.634 . . . . 0.0 113.465 -176.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -150.41 157.63 43.25 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.619 1.568 . . . . 0.0 111.261 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.27 -35.38 0.66 Allowed Glycine 0 CA--C 1.541 1.663 0 C-N-CA 125.536 1.541 . . . . 0.0 115.469 179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -154.03 -165.59 13.92 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.072 1.796 . . . . 0.0 112.825 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -126.6 20.76 7.19 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.196 1.798 . . . . 0.0 113.782 -174.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 31.3 p -76.99 48.79 0.62 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.315 1.846 . . . . 0.0 114.715 -169.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.97 -14.24 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 O-C-N 121.06 -1.025 . . . . 0.0 112.405 168.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.26 152.21 8.59 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.979 2.111 . . . . 0.0 112.08 168.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mp -75.85 81.42 2.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 123.068 1.413 . . . . 0.0 110.508 175.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -59.0 165.1 2.58 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.885 2.474 . . . . 0.0 110.56 168.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.77 -20.64 64.36 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 120.499 -1.375 . . . . 0.0 113.452 -172.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.4 m -68.29 -43.96 76.52 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 119.403 1.001 . . . . 0.0 111.287 169.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -60.37 -47.1 87.53 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 119.556 1.071 . . . . 0.0 111.36 171.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 71.6 mt -64.63 -28.58 69.72 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.118 -0.989 . . . . 0.0 112.369 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 93.6 m -71.8 -41.68 67.98 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.534 0.734 . . . . 0.0 110.841 169.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.5 mm-40 -75.95 -33.32 59.8 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -175.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.253 1.6 mp -54.21 -41.94 91.27 Favored Pre-proline 0 CA--C 1.554 1.116 0 CA-C-N 119.694 1.134 . . . . 0.0 112.654 -178.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.95 -36.81 5.57 Favored 'Trans proline' 0 C--N 1.355 0.903 0 C-N-CA 122.193 1.929 . . . . 0.0 113.823 169.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.8 mmtt -64.17 -33.43 75.77 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 120.16 1.345 . . . . 0.0 113.74 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.1 m -69.37 -23.53 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-N 118.773 0.715 . . . . 0.0 112.809 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.2 mt -80.02 -52.2 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.165 0.986 . . . . 0.0 110.189 173.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -54.33 -51.77 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 123.817 0.847 . . . . 0.0 110.489 175.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -64.73 -25.6 68.0 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 121.434 -0.791 . . . . 0.0 112.31 -178.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.83 -48.78 14.1 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 117.996 -1.002 . . . . 0.0 113.134 172.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.45 -27.58 69.08 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 121.485 1.948 . . . . 0.0 113.851 174.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -70.22 -29.17 65.92 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.829 1.651 . . . . 0.0 114.032 168.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -133.91 69.91 74.98 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 124.706 1.202 . . . . 0.0 112.304 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -55.41 -16.57 14.13 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.232 2.621 . . . . 0.0 116.356 -176.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -85.65 -27.03 25.66 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -64.33 161.3 17.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.156 0.982 . . . . 0.0 112.661 -175.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -81.22 142.0 33.61 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.856 -0.527 . . . . 0.0 110.1 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.1 tp -56.87 -35.81 69.33 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.018 0.927 . . . . 0.0 113.34 171.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.413 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -84.85 -28.25 26.18 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -171.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.2 t -62.48 -17.35 59.35 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.132 -0.98 . . . . 0.0 112.085 174.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -62.66 -6.63 3.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 119.722 -1.861 . . . . 0.0 113.929 172.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.4 -33.09 72.5 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.239 1.416 . . . . 0.0 111.665 167.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.66 -30.77 67.46 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -167.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -73.3 -30.16 63.2 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.814 1.246 . . . . 0.0 113.854 176.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -106.01 104.2 13.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.449 1.1 . . . . 0.0 112.183 -167.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.4 p -59.44 -37.72 78.85 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 174.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 58.98 179.76 0.08 Allowed 'General case' 0 CA--C 1.557 1.212 0 C-N-CA 126.922 2.089 . . . . 0.0 114.175 -176.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -69.63 -25.74 64.08 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -169.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.3 152.74 85.99 Favored Pre-proline 0 CA--C 1.555 1.147 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_exo -72.73 157.47 51.98 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.819 2.346 . . . . 0.0 111.303 167.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.171 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.096 171.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.887 0 CA-C-O 120.343 0.116 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.289 8.4 t-20 66.96 42.85 2.34 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 172.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -78.92 161.34 26.77 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 105.957 -1.868 . . . . 0.0 105.957 163.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.5 t -92.97 95.59 9.57 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.752 -1.218 . . . . 0.0 113.786 -166.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.88 -36.77 59.61 Favored 'General case' 0 CA--C 1.558 1.277 0 O-C-N 121.16 -0.962 . . . . 0.0 109.932 168.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.408 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 25.2 mtmt -67.99 -12.71 61.28 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 128.89 2.876 . . . . 0.0 116.284 178.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -133.21 19.04 4.03 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.579 1.152 . . . . 0.0 112.508 174.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.5 ttm -59.78 123.85 18.27 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.131 -1.062 . . . . 0.0 108.131 169.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -78.04 154.64 31.23 Favored 'General case' 0 N--CA 1.478 0.927 0 O-C-N 121.34 -0.85 . . . . 0.0 110.327 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.0 m -61.45 -35.09 76.63 Favored 'General case' 0 N--CA 1.468 0.425 0 O-C-N 120.482 -1.386 . . . . 0.0 112.596 -173.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -65.64 -32.33 73.85 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.306 0.957 . . . . 0.0 112.725 174.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -76.23 -37.83 57.18 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.03 1.332 . . . . 0.0 111.344 174.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -63.95 -49.43 72.6 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.944 0.898 . . . . 0.0 112.614 176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.1 pt -69.19 -2.99 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -110.79 -8.59 14.53 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.606 1.962 . . . . 0.0 114.089 172.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.6 156.89 35.73 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.747 1.158 . . . . 0.0 110.177 172.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -66.43 127.53 93.37 Favored Pre-proline 0 N--CA 1.479 0.986 0 O-C-N 121.3 -0.875 . . . . 0.0 109.662 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo -46.77 -32.18 11.82 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.683 2.922 . . . . 0.0 113.819 176.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.517 ' HG2' ' H ' ' A' ' 4' ' ' SER . 57.8 mttt -60.11 -13.82 13.84 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . 0.477 ' HB2' ' HE1' ' A' ' 8' ' ' MET . . . -132.94 22.59 4.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 121.421 1.919 . . . . 0.0 113.123 165.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.0 ttm -67.57 -54.77 17.11 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.677 1.191 . . . . 0.0 111.295 170.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 88.0 m -48.09 -55.7 17.04 Favored Pre-proline 0 N--CA 1.49 1.54 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.68 -45.42 40.49 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 124.124 3.216 . . . . 0.0 115.543 174.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.6 p -74.32 -39.99 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.391 1.451 . . . . 0.0 112.935 178.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.23 -31.86 71.65 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.185 0.594 . . . . 0.0 110.68 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.481 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 67.3 t90 -78.78 -48.61 14.49 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 117.574 -1.203 . . . . 0.0 112.541 172.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.41 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.7 t90 -64.67 -25.88 68.14 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 117.888 -1.525 . . . . 0.0 110.957 -171.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -62.0 -60.38 3.71 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.118 1.367 . . . . 0.0 111.17 167.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -27.56 67.78 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.143 1.377 . . . . 0.0 113.423 -170.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -108.97 5.2 24.06 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 175.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 59.52 156.75 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 128.186 2.594 . . . . 0.0 117.834 -177.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -73.65 -9.69 58.92 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.56 1.544 . . . . 0.0 112.526 171.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 72.7 p -71.04 162.48 29.35 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 125.717 1.607 . . . . 0.0 113.186 -176.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -87.03 148.49 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 124.403 1.081 . . . . 0.0 110.754 -178.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -80.26 161.83 24.92 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -174.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 3.2 ptpt -136.95 140.72 42.44 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.034 1.734 . . . . 0.0 110.844 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.31 -66.07 0.74 Allowed Glycine 0 CA--C 1.538 1.511 0 C-N-CA 124.44 1.019 . . . . 0.0 113.36 -172.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 160.99 125.81 0.79 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.935 1.731 . . . . 0.0 111.522 174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -92.63 -13.65 29.27 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.807 0.803 . . . . 0.0 112.817 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 19.4 m 50.4 57.28 6.77 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 -166.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 13.0 t -41.8 96.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 127.129 2.172 . . . . 0.0 113.378 -167.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.3 p -144.69 155.08 43.39 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 126.034 1.733 . . . . 0.0 109.201 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 24.0 tp -79.4 74.79 6.01 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.757 1.265 . . . . 0.0 109.728 169.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -58.03 161.25 4.17 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 128.535 2.734 . . . . 0.0 113.795 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -71.03 -22.75 62.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.774 1.027 . . . . 0.0 113.774 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 58.7 m -63.93 -48.23 77.37 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 119.149 0.886 . . . . 0.0 110.492 171.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -58.48 -51.9 67.89 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.781 0.719 . . . . 0.0 111.608 171.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.02 -30.44 61.88 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 49.1 m -81.91 -33.87 30.2 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.811 0.845 . . . . 0.0 112.347 176.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -83.17 -31.94 26.86 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 117.766 -1.112 . . . . 0.0 113.76 -177.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -50.82 -47.03 86.92 Favored Pre-proline 0 N--CA 1.481 1.1 0 CA-C-N 120.433 1.47 . . . . 0.0 113.038 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -67.31 -37.64 17.37 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 CA-C-N 122.208 1.824 . . . . 0.0 113.318 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -65.42 -36.83 85.11 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.776 -1.203 . . . . 0.0 113.152 -177.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 24.6 m -73.25 -28.44 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 O-C-N 121.777 -0.577 . . . . 0.0 112.49 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 49.7 mt -66.17 -49.23 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-N 118.191 0.45 . . . . 0.0 109.894 170.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.31 -41.61 80.24 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.406 0.683 . . . . 0.0 111.904 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.3 t80 -66.6 -27.53 67.78 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.517 -0.74 . . . . 0.0 112.923 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -76.07 -48.36 21.13 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.846 0.858 . . . . 0.0 112.184 178.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.03 -26.47 68.28 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.979 1.263 . . . . 0.0 114.294 179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . 0.279 15.2 ptpt -83.73 -10.45 58.12 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 115.926 1.824 . . . . 0.0 115.926 169.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -138.32 61.73 27.35 Favored Pre-proline 0 N--CA 1.479 0.992 0 C-N-CA 125.655 1.582 . . . . 0.0 111.439 174.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -60.81 -14.63 33.16 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.801 3.001 . . . . 0.0 115.847 -169.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -84.99 -14.54 47.17 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.843 1.257 . . . . 0.0 113.681 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -77.33 160.09 29.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.681 1.192 . . . . 0.0 112.147 -171.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -77.84 139.83 39.32 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 121.551 -0.718 . . . . 0.0 109.3 169.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -54.18 -35.76 62.66 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.089 0.956 . . . . 0.0 112.875 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.408 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -87.16 -23.03 24.96 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.502 2.038 . . . . 0.0 116.502 -170.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.1 t -64.24 -14.61 56.72 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 120.771 -1.206 . . . . 0.0 112.018 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.7 m-30 -66.06 -5.17 8.87 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 119.487 -2.008 . . . . 0.0 114.18 168.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.01 -30.05 49.84 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 119.929 1.241 . . . . 0.0 111.565 166.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -64.98 -33.68 76.61 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.921 1.289 . . . . 0.0 112.037 -171.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -73.07 -28.8 62.52 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.528 1.931 . . . . 0.0 115.647 173.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -101.78 109.63 21.43 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -166.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 39.4 m -78.76 80.58 5.12 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.301 -0.874 . . . . 0.0 110.27 168.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -71.56 176.8 4.47 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.301 1.04 . . . . 0.0 112.667 -176.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -66.78 -3.73 7.43 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 116.809 2.152 . . . . 0.0 116.809 -168.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.42 145.9 98.19 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 124.19 0.996 . . . . 0.0 113.406 176.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -64.11 156.61 58.07 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.063 2.509 . . . . 0.0 113.614 170.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.178 0 C-N-CA 125.602 1.561 . . . . 0.0 111.084 178.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.004 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.254 7.3 t-20 58.23 45.39 17.36 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.52 1.528 . . . . 0.0 114.406 174.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.461 ' HB3' ' HE3' ' B' ' 98' ' ' LYS . 20.2 mm-40 -56.38 -22.74 33.28 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.802 1.241 . . . . 0.0 113.164 168.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 101.92 100.46 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 129.462 3.105 . . . . 0.0 114.919 168.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.73 -33.55 73.07 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.313 -1.492 . . . . 0.0 112.588 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.427 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.3 ptpt -74.31 -12.46 60.55 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 114.776 1.399 . . . . 0.0 114.776 177.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -106.02 6.08 30.9 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.452 1.101 . . . . 0.0 112.594 168.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 43.0 ttm -62.02 129.31 40.3 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.724 -1.235 . . . . 0.0 109.722 171.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.88 155.12 27.92 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 121.049 -1.032 . . . . 0.0 110.481 174.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.88 -32.61 74.19 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.264 -1.522 . . . . 0.0 113.417 -175.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.86 -31.47 71.74 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 170.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -81.22 -35.0 31.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.39 1.476 . . . . 0.0 111.53 176.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -57.94 -50.45 73.31 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 121.562 -0.711 . . . . 0.0 112.658 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.1 pt -69.57 -0.66 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 125.262 1.425 . . . . 0.0 113.042 177.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -111.54 -11.28 14.08 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.351 1.46 . . . . 0.0 114.318 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.42 165.99 24.04 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.188 -0.945 . . . . 0.0 111.622 174.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.423 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 49.9 t-20 -65.74 128.72 94.02 Favored Pre-proline 0 N--CA 1.483 1.191 0 O-C-N 120.941 -1.099 . . . . 0.0 112.542 -177.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 34.2 Cg_exo -57.65 -12.74 12.15 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 124.556 3.504 . . . . 0.0 116.521 177.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 9.3 mttt -65.75 -67.44 0.44 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 126.029 1.731 . . . . 0.0 109.672 166.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.64 -6.47 52.18 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 73.6 mtp -57.06 -30.74 64.53 Favored 'General case' 0 N--CA 1.481 1.096 0 O-C-N 121.009 -1.057 . . . . 0.0 112.155 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.267 23.7 m -68.15 -56.1 11.62 Favored Pre-proline 0 N--CA 1.481 1.076 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -176.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.67 -36.62 82.09 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 123.173 2.582 . . . . 0.0 114.768 168.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.405 HG22 ' HG2' ' B' ' 102' ' ' PRO . 66.2 t -63.74 -53.97 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 118.504 0.593 . . . . 0.0 111.067 175.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.21 -30.3 71.37 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.786 1.235 . . . . 0.0 111.685 -177.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 64.0 t90 -77.68 -52.74 8.49 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 117.575 -1.203 . . . . 0.0 113.459 169.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.494 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 3.0 t90 -66.44 -34.22 77.45 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.761 1.619 . . . . 0.0 111.886 -167.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 58.0 ttp -54.3 -44.2 71.78 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.958 0.903 . . . . 0.0 112.115 169.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.22 -32.67 44.04 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.281 1.432 . . . . 0.0 112.909 -171.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -121.13 -16.71 7.93 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -173.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 62.38 170.67 0.13 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 117.917 2.562 . . . . 0.0 117.917 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.76 2.6 35.84 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.596 2.358 . . . . 0.0 112.505 172.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.0 p -65.79 14.81 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 128.205 2.602 . . . . 0.0 116.445 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.5 t 61.61 127.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 129.123 2.969 . . . . 0.0 114.26 -175.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -67.64 156.07 37.71 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.02 0.928 . . . . 0.0 111.825 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.9 mmpt? -82.83 0.86 42.03 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -169.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.71 -25.47 0.1 OUTLIER Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.551 1.072 . . . . 0.0 114.962 174.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.97 -178.36 50.02 Favored Glycine 0 CA--C 1.538 1.519 0 CA-C-N 118.279 1.039 . . . . 0.0 114.827 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -124.88 24.5 7.62 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.557 1.943 . . . . 0.0 112.453 174.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.0 m -75.52 65.29 1.73 Allowed 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.784 1.633 . . . . 0.0 113.508 -168.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -67.56 -15.54 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 124.667 1.187 . . . . 0.0 112.545 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.39 136.62 53.61 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.277 1.831 . . . . 0.0 111.727 175.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 20.8 tp -78.43 77.77 4.91 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.733 1.254 . . . . 0.0 109.839 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -61.11 165.82 4.05 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.857 2.863 . . . . 0.0 113.216 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.83 -24.01 65.23 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 120.78 -1.2 . . . . 0.0 113.985 -172.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 90.6 m -65.11 -47.63 76.51 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 119.363 0.983 . . . . 0.0 110.656 169.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.53 -47.4 84.31 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.897 0.771 . . . . 0.0 111.185 172.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.5 mt -64.24 -25.24 67.97 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.892 -1.13 . . . . 0.0 112.219 -178.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.8 m -77.83 -35.49 51.11 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.059 0.944 . . . . 0.0 111.701 172.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -88.49 -27.81 21.23 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.06 -43.64 85.18 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 117.483 -1.246 . . . . 0.0 112.913 174.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.69 -40.36 10.13 Favored 'Trans proline' 0 C--N 1.352 0.726 0 CA-C-N 122.16 1.807 . . . . 0.0 113.572 169.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 25.3 mmtp -63.35 -37.23 86.48 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.954 1.252 . . . . 0.0 112.928 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.2 m -68.97 -28.38 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 178.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -72.31 -51.43 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 121.622 -0.674 . . . . 0.0 109.685 173.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -55.99 -43.09 77.31 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.141 0.977 . . . . 0.0 111.415 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.29 -30.49 69.51 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.831 -0.543 . . . . 0.0 111.375 -177.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.77 -42.7 57.67 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.11 -0.994 . . . . 0.0 112.807 174.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -31.08 68.83 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 120.764 1.62 . . . . 0.0 114.284 176.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 pttt -82.6 -25.71 32.97 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -130.9 73.95 80.5 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 125.767 1.627 . . . . 0.0 110.603 170.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -60.52 -11.45 16.95 Favored 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 124.731 3.621 . . . . 0.0 115.722 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -81.92 -25.14 35.18 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.806 1.642 . . . . 0.0 112.613 -175.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -66.41 154.61 39.69 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.114 0.966 . . . . 0.0 111.395 -172.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -89.62 127.42 35.9 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 174.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.2 tp -45.26 -51.5 10.77 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -166.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.427 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -70.92 -6.74 40.75 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -174.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 80.5 p -56.74 -28.21 60.69 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 120.75 -1.219 . . . . 0.0 110.969 167.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -71.16 -2.26 15.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.515 1.526 . . . . 0.0 114.307 178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tptt -83.41 -31.08 26.85 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.977 1.311 . . . . 0.0 111.811 167.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -69.5 -28.69 66.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.313 1.045 . . . . 0.0 111.94 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -75.63 -31.53 59.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.624 1.57 . . . . 0.0 114.988 173.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -116.28 93.9 4.42 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 112.425 -166.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.3 m -56.99 -42.44 80.26 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.656 1.183 . . . . 0.0 113.339 -174.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.6 t30 61.66 172.55 0.12 Allowed 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 128.059 2.544 . . . . 0.0 115.737 177.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -80.23 42.15 0.56 Allowed 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 -167.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 5.8 mp -73.53 -33.33 1.84 Allowed Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 114.808 1.41 . . . . 0.0 114.808 174.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -79.83 144.58 17.31 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.669 2.913 . . . . 0.0 114.045 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.584 2.258 0 C-N-CA 125.766 1.626 . . . . 0.0 108.24 171.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.875 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 45.2 t30 55.87 69.21 0.76 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.243 1.817 . . . . 0.0 113.633 -176.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.428 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 20.8 mm-40 -64.1 -9.97 19.69 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.03 1.332 . . . . 0.0 114.019 169.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 75.6 m 117.99 78.91 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 130.885 3.674 . . . . 0.0 112.665 170.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.4 -39.37 70.11 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.156 -1.59 . . . . 0.0 111.905 178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.444 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 2.3 ptpt -78.82 3.63 16.24 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 176.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -124.97 9.88 8.17 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.8 1.24 . . . . 0.0 112.2 169.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 37.6 ttm -61.5 124.7 21.37 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.476 1.034 . . . . 0.0 109.427 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -76.69 153.24 35.31 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 121.757 -0.589 . . . . 0.0 110.008 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -66.93 -28.27 68.16 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.323 -1.486 . . . . 0.0 113.88 -170.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -67.23 -31.85 72.48 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 118.806 0.73 . . . . 0.0 112.551 169.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.0 tt0 -75.71 -37.96 59.01 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.004 1.322 . . . . 0.0 111.28 176.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -60.01 -50.34 74.11 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.8 pt -67.85 -4.83 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.99 -10.34 17.29 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.957 1.703 . . . . 0.0 113.886 172.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.67 157.77 37.4 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 119.81 1.187 . . . . 0.0 111.199 174.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.64 134.75 89.23 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 123.603 0.761 . . . . 0.0 113.036 -178.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -72.59 -7.19 20.42 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.719 1.612 . . . . 0.0 115.947 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' A' ' 3' ' ' GLU . 6.3 mptt -71.3 -53.79 13.05 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 120.926 1.694 . . . . 0.0 108.712 167.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.32 -15.6 54.92 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 36.3 ttm -54.03 -33.33 57.01 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.636 -0.665 . . . . 0.0 112.6 172.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 30.9 m -65.4 -58.24 12.59 Favored Pre-proline 0 N--CA 1.485 1.276 0 CA-C-O 117.757 -1.116 . . . . 0.0 112.773 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.405 ' HG2' HG22 ' A' ' 24' ' ' VAL . 7.5 Cg_endo -51.79 -41.98 59.64 Favored 'Trans proline' 0 C--N 1.359 1.082 0 C-N-CA 124.053 3.168 . . . . 0.0 115.033 172.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.4 p -72.92 -42.49 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.637 1.108 . . . . 0.0 113.034 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.69 -29.08 69.85 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 118.654 -0.688 . . . . 0.0 111.086 174.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.2 t90 -77.56 -51.9 9.93 Favored 'General case' 0 C--N 1.341 0.239 0 CA-C-O 117.728 -1.13 . . . . 0.0 112.16 170.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -65.84 -29.24 69.67 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.801 1.637 . . . . 0.0 111.21 -169.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 2.8 ttp -65.82 -39.25 90.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.726 1.61 . . . . 0.0 111.895 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -79.1 -34.91 43.1 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.543 1.137 . . . . 0.0 112.43 -177.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.52 -26.86 27.79 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.168 -1.583 . . . . 0.0 114.239 170.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 70.48 142.62 0.05 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 127.559 2.344 . . . . 0.0 114.157 -170.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -76.28 -8.54 57.3 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 7.2 p -62.29 143.66 56.61 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.901 1.28 . . . . 0.0 111.996 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.5 p -70.64 141.35 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -168.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 7.0 m-30 -75.27 171.48 14.12 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.655 1.582 . . . . 0.0 113.274 -175.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 65.1 mmtt -115.19 26.9 9.76 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.103 1.761 . . . . 0.0 112.635 -169.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.78 -2.21 66.56 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 126.501 2.001 . . . . 0.0 115.228 -174.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.02 166.23 52.72 Favored Glycine 0 CA--C 1.538 1.484 0 CA-C-N 118.524 1.162 . . . . 0.0 114.221 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -111.69 22.09 15.37 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.861 1.665 . . . . 0.0 113.927 -177.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 14.3 p -71.47 33.72 0.05 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 127.232 2.213 . . . . 0.0 114.625 -175.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 28.8 m -80.95 -4.51 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 O-C-N 120.295 -1.503 . . . . 0.0 112.05 168.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 22.4 p -66.06 156.7 33.05 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.187 2.195 . . . . 0.0 113.02 170.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 10.1 mp -93.91 149.17 21.46 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.115 0.966 . . . . 0.0 108.795 168.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 21.3 p30 -143.68 174.66 10.6 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.139 0.976 . . . . 0.0 112.96 -169.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.67 -32.93 73.14 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.098 0.959 . . . . 0.0 113.403 -174.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 65.9 m -70.54 -50.31 38.93 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.717 -0.614 . . . . 0.0 110.174 172.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.25 -55.11 37.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.958 0.903 . . . . 0.0 112.658 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 pp -62.05 -27.27 68.78 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 21.8 m -81.28 -31.49 33.63 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 122.502 0.321 . . . . 0.0 111.504 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.8 mm100 -84.06 -26.1 29.31 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 117.389 -1.291 . . . . 0.0 114.472 -178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.16 -42.28 79.81 Favored Pre-proline 0 N--CA 1.482 1.15 0 CA-C-N 121.533 1.969 . . . . 0.0 113.983 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -72.44 -36.02 5.71 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 CA-C-N 122.487 1.924 . . . . 0.0 113.255 169.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -67.88 -30.78 70.23 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.697 -1.252 . . . . 0.0 113.923 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.0 m -70.9 -31.21 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.989 0.813 . . . . 0.0 111.431 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 42.4 mt -68.15 -50.66 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.586 0.754 . . . . 0.0 109.864 171.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -55.19 -44.65 75.48 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.852 0.861 . . . . 0.0 111.571 173.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -66.17 -37.03 84.64 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.458 1.026 . . . . 0.0 111.888 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.7 m -68.9 -36.66 78.31 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.456 -0.777 . . . . 0.0 112.189 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -58.3 -51.21 70.73 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.43 1.492 . . . . 0.0 112.648 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 pttt -84.87 -21.58 29.71 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 27.2 m-80 -128.92 76.87 78.65 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.896 1.679 . . . . 0.0 109.672 170.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -65.09 -9.69 22.72 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.895 3.064 . . . . 0.0 114.957 -176.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -81.96 -21.44 37.2 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.312 1.445 . . . . 0.0 112.833 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -70.37 159.65 33.75 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.441 1.097 . . . . 0.0 111.992 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -92.66 130.26 38.35 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 169.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 65.6 tp -45.33 -47.41 13.24 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.999 1.32 . . . . 0.0 114.244 -172.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.444 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.8 m-85 -72.53 -8.76 56.79 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -174.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 70.3 p -60.53 -24.53 65.44 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 120.677 -1.264 . . . . 0.0 111.61 168.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -72.43 -1.18 14.7 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.831 1.253 . . . . 0.0 114.26 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -80.73 -31.85 35.89 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.663 1.12 . . . . 0.0 111.572 165.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -68.75 -29.05 67.37 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.709 1.204 . . . . 0.0 112.465 -169.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -68.94 -30.01 68.37 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.918 1.687 . . . . 0.0 114.115 169.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -93.44 -45.66 7.68 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 44.2 m 48.27 32.12 2.99 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 125.955 1.702 . . . . 0.0 114.95 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 12.9 p-10 -89.89 163.22 15.09 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.855 2.062 . . . . 0.0 114.121 -169.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 59.39 -6.6 0.06 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 118.239 2.681 . . . . 0.0 118.239 168.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -147.82 159.84 39.65 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 126.832 2.053 . . . . 0.0 110.845 170.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -62.51 153.47 71.03 Favored 'Trans proline' 0 CA--C 1.539 0.765 0 C-N-CA 122.97 2.447 . . . . 0.0 114.399 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.123 1.769 . . . . 0.0 111.878 178.453 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.903 0 CA-C-O 121.321 0.582 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.281 46.0 t30 60.29 44.77 12.09 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.373 1.869 . . . . 0.0 115.583 175.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -67.21 -22.36 65.71 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.399 164.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 26.5 m 90.69 99.76 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 129.685 3.194 . . . . 0.0 117.808 165.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.99 -32.4 66.06 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 119.87 -1.769 . . . . 0.0 111.861 169.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 32.0 mttt -58.92 -22.81 60.44 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 126.989 2.116 . . . . 0.0 114.86 175.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -119.29 6.01 11.2 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.895 1.678 . . . . 0.0 112.756 -179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -61.84 127.41 31.27 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 120.924 -1.11 . . . . 0.0 109.755 175.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -79.58 155.19 28.26 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 121.292 -0.88 . . . . 0.0 110.022 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -63.39 -33.84 76.43 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 120.454 -1.404 . . . . 0.0 113.187 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -64.09 -32.24 73.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.774 0.716 . . . . 0.0 112.881 172.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -77.22 -38.18 51.79 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.885 1.274 . . . . 0.0 111.836 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -59.09 -50.37 74.31 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.818 0.847 . . . . 0.0 112.438 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.1 pt -68.36 -5.07 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 C-N-CA 124.454 1.102 . . . . 0.0 112.925 177.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -105.75 -8.98 17.5 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 125.735 1.614 . . . . 0.0 113.543 173.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.14 157.89 33.94 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 119.758 1.163 . . . . 0.0 110.462 173.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 53.9 t-20 -66.83 129.74 94.03 Favored Pre-proline 0 N--CA 1.482 1.132 0 O-C-N 121.216 -0.927 . . . . 0.0 111.426 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_exo -52.17 -27.82 31.18 Favored 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.385 2.723 . . . . 0.0 115.019 177.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -51.32 -66.5 0.37 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.769 1.628 . . . . 0.0 111.078 170.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . 0.255 . . -83.07 -4.55 58.47 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 178.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.2 ttt -64.65 -36.55 84.61 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 120.857 -1.152 . . . . 0.0 112.211 168.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.9 m -60.45 -51.83 77.22 Favored Pre-proline 0 N--CA 1.478 0.939 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -178.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.4 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 10.0 Cg_endo -54.94 -46.3 34.37 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.16 2.573 . . . . 0.0 115.309 169.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.96 -35.52 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 CA-C-N 119.765 1.166 . . . . 0.0 113.154 178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.12 -18.34 64.33 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.167 0.802 . . . . 0.0 113.167 175.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.45 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.2 t90 -95.69 -48.6 5.72 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.181 0.901 . . . . 0.0 111.665 168.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.512 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 56.6 t-105 -64.24 -34.58 78.43 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.563 1.145 . . . . 0.0 111.922 -170.253 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.2 tmm? -67.18 -46.78 72.93 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 124.831 1.252 . . . . 0.0 111.385 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -66.61 -35.1 79.37 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.775 1.23 . . . . 0.0 112.749 -169.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -98.25 -4.05 36.08 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.263 1.208 . . . . 0.0 114.263 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 57.08 -179.53 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.883 1.673 . . . . 0.0 113.654 -169.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -73.62 41.67 0.12 Allowed 'General case' 0 CA--C 1.555 1.158 0 O-C-N 120.069 -1.645 . . . . 0.0 113.006 172.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 13.5 t -69.58 153.95 42.71 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 126.133 1.773 . . . . 0.0 114.62 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.42 -4.71 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 125.454 1.501 . . . . 0.0 113.373 168.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.5 t80 67.15 27.66 8.44 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt 53.46 30.65 10.85 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 126.361 1.865 . . . . 0.0 114.498 170.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.88 1.85 88.73 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 125.429 1.49 . . . . 0.0 115.254 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.78 -176.61 51.56 Favored Glycine 0 CA--C 1.535 1.317 0 CA-C-N 119.072 1.436 . . . . 0.0 114.076 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -134.11 -14.93 2.31 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.6 p -78.71 44.75 0.55 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.941 2.097 . . . . 0.0 114.138 -169.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.63 14.53 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 126.257 1.823 . . . . 0.0 114.465 178.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.64 152.25 22.83 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.458 2.303 . . . . 0.0 113.189 -176.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.3 mp -77.12 72.98 3.7 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.508 1.523 . . . . 0.0 110.173 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -67.12 165.64 15.53 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.935 2.494 . . . . 0.0 112.892 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -67.84 -26.45 66.06 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.085 -1.634 . . . . 0.0 113.47 -171.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.6 m -65.77 -47.86 73.76 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.41 -0.807 . . . . 0.0 110.431 169.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -56.1 -48.0 76.99 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.615 -0.678 . . . . 0.0 111.198 174.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.1 -27.37 69.35 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.056 -1.027 . . . . 0.0 112.436 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 97.0 m -76.39 -35.39 58.65 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.405 1.082 . . . . 0.0 111.615 172.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.53 -28.17 31.21 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 119.453 1.024 . . . . 0.0 113.642 -178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.256 1.5 mp -52.93 -40.68 80.45 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.301 1.41 . . . . 0.0 113.628 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.44 -37.01 3.47 Favored 'Trans proline' 0 C--N 1.353 0.779 0 CA-C-N 122.225 1.83 . . . . 0.0 113.175 168.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.8 mmtt -64.57 -34.3 77.94 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.302 -1.499 . . . . 0.0 113.65 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.74 -15.85 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 174.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.0 mt -91.38 -51.27 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 124.456 1.102 . . . . 0.0 110.663 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.5 -48.39 71.92 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.942 0.897 . . . . 0.0 110.321 175.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -65.26 -23.57 67.08 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.282 -0.886 . . . . 0.0 112.62 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -79.7 -48.42 13.7 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.309 0.959 . . . . 0.0 112.668 172.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.8 -27.17 69.0 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 120.851 1.66 . . . . 0.0 113.892 174.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.8 mtpp -72.5 -31.0 65.01 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.67 1.588 . . . . 0.0 114.884 169.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -130.81 64.52 73.84 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 125.173 1.389 . . . . 0.0 111.369 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -59.51 -14.87 27.54 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 124.267 3.311 . . . . 0.0 115.726 -172.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -84.61 -20.85 30.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.604 1.562 . . . . 0.0 113.797 -179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -73.46 162.27 29.47 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.993 1.317 . . . . 0.0 112.248 -172.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -77.68 154.1 32.45 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.923 -0.486 . . . . 0.0 110.04 169.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.9 tp -69.36 -36.7 77.1 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.28 -0.887 . . . . 0.0 113.382 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.3 m-85 -88.05 -21.09 24.95 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 -168.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.3 t -59.16 -22.17 60.53 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.285 -0.884 . . . . 0.0 111.549 170.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -58.67 -16.46 16.4 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 119.555 -1.966 . . . . 0.0 113.394 171.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -58.07 -34.57 70.27 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.31 0.959 . . . . 0.0 112.473 167.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.81 -25.6 67.98 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.962 0.887 . . . . 0.0 112.303 -169.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.54 -32.88 73.97 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.344 2.258 . . . . 0.0 113.616 172.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.24 126.36 46.53 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.083 1.353 . . . . 0.0 112.731 -166.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 79.2 p -109.05 -8.08 15.24 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.79 1.774 . . . . 0.0 115.79 -173.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -89.01 13.39 13.03 Favored 'General case' 0 CA--C 1.553 1.067 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -169.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -77.58 17.88 0.49 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 -171.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -161.73 160.01 22.63 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.752 2.021 . . . . 0.0 111.719 -177.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -59.66 156.21 38.54 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.34 2.694 . . . . 0.0 113.149 169.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 47.0 t30 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 125.626 1.57 . . . . 0.0 111.877 177.371 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.986 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 65.73 -64.68 0.19 Allowed 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 129.433 3.093 . . . . 0.0 113.404 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.321 33.3 mm-40 58.57 -26.23 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 116.492 2.034 . . . . 0.0 116.492 -170.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 70.7 m 107.48 79.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 131.205 3.802 . . . . 0.0 114.017 167.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.7 -41.49 61.49 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 121.068 -1.02 . . . . 0.0 110.837 172.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.443 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 13.8 mtmt -63.19 -15.1 55.86 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.299 2.239 . . . . 0.0 115.809 175.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -123.85 7.72 8.73 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.456 1.502 . . . . 0.0 112.799 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 31.0 ttm -59.6 125.25 22.9 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 119.765 1.166 . . . . 0.0 109.353 174.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.56 153.76 33.03 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.628 -0.67 . . . . 0.0 110.207 -178.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.8 m -62.93 -32.49 73.79 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.427 -1.421 . . . . 0.0 112.8 -173.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 tp60 -66.52 -30.88 71.31 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.968 0.804 . . . . 0.0 112.89 173.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -77.5 -38.69 48.51 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.794 1.238 . . . . 0.0 111.315 173.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.76 -51.27 70.46 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 123.486 0.714 . . . . 0.0 112.316 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.2 pt -68.27 -3.29 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.832 0.853 . . . . 0.0 112.861 178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -105.72 -9.12 17.45 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 126.053 1.741 . . . . 0.0 114.112 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.57 158.13 36.76 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 119.828 1.195 . . . . 0.0 111.065 174.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.408 HD21 ' HD2' ' B' ' 98' ' ' LYS . 49.0 t-20 -67.82 132.49 92.39 Favored Pre-proline 0 N--CA 1.485 1.283 0 O-C-N 121.04 -1.037 . . . . 0.0 112.128 -173.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -57.29 -16.91 24.15 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 123.829 3.019 . . . . 0.0 115.829 175.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.2 mttt -61.89 -64.11 1.04 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.0 1.72 . . . . 0.0 109.458 166.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.2 -4.18 56.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -177.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.8 mmt -52.42 -45.42 65.93 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 119.61 1.096 . . . . 0.0 111.704 168.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 83.3 m -60.88 -52.8 69.74 Favored Pre-proline 0 N--CA 1.48 1.05 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.877 -172.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -49.87 -49.46 15.96 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.232 3.288 . . . . 0.0 115.202 169.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.2 p -72.4 -36.41 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 CA-C-N 119.485 1.039 . . . . 0.0 112.934 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.3 -24.98 67.43 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.518 1.127 . . . . 0.0 111.35 175.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.523 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.6 t90 -84.21 -53.83 5.23 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 117.826 -1.083 . . . . 0.0 110.883 166.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.523 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.9 t90 -62.29 -33.03 73.87 Favored 'General case' 0 N--CA 1.44 -0.95 0 C-N-CA 116.495 -2.082 . . . . 0.0 113.159 -164.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -59.72 -42.57 93.38 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.225 1.01 . . . . 0.0 112.635 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 -31.51 67.13 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 126.525 1.93 . . . . 0.0 112.435 -172.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -104.85 -12.31 16.33 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 174.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 64.37 166.42 0.15 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.219 2.208 . . . . 0.0 114.457 -168.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.43 20.94 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.188 1.395 . . . . 0.0 113.834 170.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 3.4 t -65.56 170.19 5.32 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.185 1.394 . . . . 0.0 113.792 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 8.7 p -103.82 147.61 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 126.074 1.75 . . . . 0.0 108.171 170.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . 0.253 0.5 OUTLIER -77.6 158.87 29.59 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 115.267 1.581 . . . . 0.0 115.267 -168.101 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 5.5 ptpt -149.41 149.35 30.68 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.207 1.403 . . . . 0.0 112.504 -169.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 67.88 5.16 37.84 Favored Glycine 0 CA--C 1.542 1.725 0 N-CA-C 116.589 1.396 . . . . 0.0 116.589 175.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 161.58 -157.88 29.62 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.165 1.364 . . . . 0.0 112.795 -174.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -119.76 15.84 12.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.472 1.909 . . . . 0.0 113.591 -178.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.57 35.19 0.08 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.684 1.994 . . . . 0.0 114.893 -169.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 34.2 m -64.98 -12.63 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 120.918 -1.114 . . . . 0.0 112.656 169.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.41 145.12 11.82 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.168 1.787 . . . . 0.0 111.703 168.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 70.2 mt -78.78 127.41 32.01 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 121.589 -0.694 . . . . 0.0 110.699 175.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 18.0 m-80 -92.98 163.87 13.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.773 1.629 . . . . 0.0 110.371 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -63.12 -27.26 69.26 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 120.589 -1.319 . . . . 0.0 112.05 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 81.2 m -58.77 -41.75 87.35 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.047 0.939 . . . . 0.0 111.21 168.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -72.69 -45.5 58.52 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.653 -0.654 . . . . 0.0 109.995 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -56.32 -30.18 62.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.385 0.674 . . . . 0.0 112.259 173.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.6 m -79.7 -39.4 31.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.222 1.009 . . . . 0.0 112.092 172.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -70.89 -36.67 72.85 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.512 -1.368 . . . . 0.0 113.545 -179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.97 -41.95 90.66 Favored Pre-proline 0 CA--C 1.552 1.024 0 CA-C-O 117.678 -1.153 . . . . 0.0 113.592 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -76.0 -35.47 2.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.094 1.863 . . . . 0.0 113.653 169.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -67.22 -28.05 67.74 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 120.189 -1.569 . . . . 0.0 114.166 -175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.1 m -71.2 -24.72 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 O-C-N 121.843 -0.536 . . . . 0.0 112.035 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 36.7 mt -74.22 -47.95 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.196 0.999 . . . . 0.0 109.965 170.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -54.65 -48.27 72.51 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.745 0.818 . . . . 0.0 112.029 172.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -68.0 -24.74 65.16 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.792 -1.193 . . . . 0.0 112.151 -176.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -76.54 -47.67 21.87 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 118.422 -0.799 . . . . 0.0 112.626 173.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.79 -26.16 67.57 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 120.826 1.648 . . . . 0.0 114.047 176.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -69.45 -30.37 68.27 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 167.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -133.7 64.79 69.11 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.975 1.31 . . . . 0.0 112.395 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -58.7 -16.73 32.16 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.101 2.534 . . . . 0.0 116.704 -170.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -83.24 -15.02 51.97 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.998 1.319 . . . . 0.0 113.347 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.04 162.36 28.11 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.891 1.277 . . . . 0.0 112.007 -172.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -76.98 157.09 31.45 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 169.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.8 tp -73.0 -48.45 36.23 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 174.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.443 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.1 m-85 -77.86 -18.06 56.66 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 116.161 1.911 . . . . 0.0 116.161 -168.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.2 t -58.88 -24.2 61.93 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.383 -0.823 . . . . 0.0 111.686 169.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.9 m-30 -61.51 -4.1 1.22 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 119.787 -1.82 . . . . 0.0 114.242 171.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -71.21 -31.92 68.17 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.705 1.139 . . . . 0.0 112.168 166.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -63.11 -34.13 76.95 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -168.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -70.13 -26.27 63.87 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.824 2.05 . . . . 0.0 114.766 171.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -99.95 109.8 22.14 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.432 1.493 . . . . 0.0 113.204 -168.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 27.1 m -93.83 0.51 56.28 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 115.168 1.544 . . . . 0.0 115.168 -174.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -82.42 7.41 14.26 Favored 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -170.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -76.71 -1.76 29.51 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -175.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -149.26 153.28 37.41 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 127.074 2.15 . . . . 0.0 110.589 175.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.69 156.62 64.89 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 123.124 2.549 . . . . 0.0 112.402 171.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.257 0 C-N-CA 125.51 1.524 . . . . 0.0 111.275 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.037 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.307 7.5 t-20 65.91 30.22 9.95 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 170.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -58.89 -36.56 74.87 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.689 0.796 . . . . 0.0 110.163 165.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t 80.26 117.5 0.06 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 128.601 2.761 . . . . 0.0 117.439 167.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.16 -25.41 63.89 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.314 -0.866 . . . . 0.0 113.17 175.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 63.9 mttt -59.82 -30.26 68.8 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.603 1.561 . . . . 0.0 113.097 177.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -107.6 4.62 26.12 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.062 1.745 . . . . 0.0 113.144 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 52.1 ttm -64.62 124.84 22.93 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.855 -1.153 . . . . 0.0 110.374 175.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.1 t -79.81 155.68 27.75 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.013 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -62.35 -34.38 76.55 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.57 -1.331 . . . . 0.0 112.898 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.5 tp60 -60.47 -32.03 71.02 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.342 0.868 . . . . 0.0 113.342 171.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -82.37 -37.63 25.34 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.265 1.426 . . . . 0.0 111.602 178.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -59.42 -48.39 81.84 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.641 0.777 . . . . 0.0 112.61 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -68.27 -3.66 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 124.18 0.992 . . . . 0.0 112.618 176.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -111.99 -4.8 14.41 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 125.627 1.571 . . . . 0.0 114.148 176.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.78 159.44 32.92 Favored 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.78 -1.2 . . . . 0.0 111.389 177.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -54.01 134.02 58.5 Favored Pre-proline 0 N--CA 1.484 1.227 0 C-N-CA 124.81 1.244 . . . . 0.0 113.8 178.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -68.48 -15.49 41.8 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.085 2.523 . . . . 0.0 116.223 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HB2' ' HE2' ' B' ' 87' ' ' MET . 7.2 mptt -71.08 -55.51 8.08 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 120.759 1.618 . . . . 0.0 109.331 170.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.44 -0.18 48.95 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -175.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.3 ttt -61.76 -40.42 95.08 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.256 23.2 m -66.94 -50.95 40.36 Favored Pre-proline 0 N--CA 1.481 1.093 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 -175.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.1 -42.13 47.02 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.607 2.871 . . . . 0.0 115.538 169.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.2 p -73.64 -40.75 54.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 CA-C-N 119.432 1.014 . . . . 0.0 113.241 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.75 66.65 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.754 0.822 . . . . 0.0 111.494 174.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.494 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 76.7 t90 -87.97 -50.48 6.39 Favored 'General case' 0 C--N 1.342 0.247 0 CA-C-O 117.05 -1.452 . . . . 0.0 112.104 168.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.42 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 2.0 t90 -67.62 -26.9 66.47 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 121.685 2.039 . . . . 0.0 112.12 -168.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.41 -43.01 91.92 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.663 0.785 . . . . 0.0 111.777 169.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.57 -32.88 62.54 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.812 1.645 . . . . 0.0 111.766 -176.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -136.91 107.54 6.55 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.729 2.011 . . . . 0.0 109.695 167.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -72.51 171.93 11.45 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -178.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.82 1.81 1.23 Allowed 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 172.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.5 t -53.14 140.78 24.9 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.751 1.221 . . . . 0.0 111.775 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.37 132.57 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.708 -0.62 . . . . 0.0 110.673 -172.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.53 159.1 34.48 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.99 1.316 . . . . 0.0 113.836 -173.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -143.5 148.0 35.35 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.636 1.574 . . . . 0.0 112.395 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.36 4.83 65.45 Favored Glycine 0 CA--C 1.543 1.8 0 C-N-CA 124.365 0.983 . . . . 0.0 115.508 -176.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 146.64 -161.45 28.39 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.1 1.809 . . . . 0.0 111.554 -173.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -124.46 -116.17 0.29 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.327 1.051 . . . . 0.0 111.037 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.3 m 63.04 45.06 5.47 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.884 1.274 . . . . 0.0 111.637 -169.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.5 m -72.75 7.78 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.375 0 O-C-N 121.2 -0.937 . . . . 0.0 113.483 169.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.404 HG23 HG23 ' B' ' 113' ' ' VAL . 0.0 OUTLIER -52.64 157.45 1.57 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.849 1.659 . . . . 0.0 112.005 168.903 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 tp -72.99 77.85 1.18 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 165.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.0 p30 -73.72 170.76 14.61 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.848 1.659 . . . . 0.0 112.937 -168.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -67.01 -26.23 66.68 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 120.235 -1.541 . . . . 0.0 113.746 -171.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 86.2 m -70.33 -40.78 73.93 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 121.432 -0.792 . . . . 0.0 110.395 169.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -59.97 -42.6 94.48 Favored 'General case' 0 C--O 1.221 -0.442 0 O-C-N 121.15 -0.969 . . . . 0.0 110.348 174.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.02 -21.52 66.54 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 120.969 -1.082 . . . . 0.0 112.207 177.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.4 m -81.48 -37.42 27.95 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.987 0.915 . . . . 0.0 111.438 169.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -83.74 -28.07 28.48 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.776 1.171 . . . . 0.0 113.864 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.27 -42.88 96.22 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 119.985 1.266 . . . . 0.0 112.152 176.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -70.53 -35.5 10.3 Favored 'Trans proline' 0 C--N 1.353 0.788 0 CA-C-N 122.145 1.802 . . . . 0.0 113.269 169.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -66.1 -36.33 82.9 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 120.109 -1.62 . . . . 0.0 113.671 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.12 -20.78 26.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.798 0.727 . . . . 0.0 112.573 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 39.3 mt -82.34 -50.67 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.062 0.945 . . . . 0.0 110.558 171.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.25 -38.71 77.43 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 123.853 0.861 . . . . 0.0 111.9 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -69.41 -29.09 66.75 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.954 0.502 . . . . 0.0 111.601 178.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.6 m -77.19 -46.27 23.88 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.922 174.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -29.47 68.41 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.974 1.716 . . . . 0.0 114.159 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -75.64 -29.08 59.04 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 173.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -134.66 74.63 64.67 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.971 1.309 . . . . 0.0 111.871 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -58.37 -12.44 13.56 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 124.442 3.428 . . . . 0.0 117.445 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -79.63 -23.95 42.25 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.884 1.273 . . . . 0.0 113.401 -178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt -64.85 154.66 36.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.37 1.068 . . . . 0.0 112.085 -174.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -80.99 151.58 28.39 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.427 -0.796 . . . . 0.0 109.622 171.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.0 tp -66.33 -36.55 83.2 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 120.86 -1.15 . . . . 0.0 113.132 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -84.45 -20.94 30.93 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.298 1.592 . . . . 0.0 115.298 -169.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -64.27 -14.54 56.47 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.214 -0.929 . . . . 0.0 112.288 169.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -66.78 -3.52 6.95 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 119.156 -2.215 . . . . 0.0 113.906 169.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -32.77 56.18 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.71 1.204 . . . . 0.0 111.199 165.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -65.69 -29.93 70.54 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.69 1.596 . . . . 0.0 112.279 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -74.24 -29.61 61.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.579 1.552 . . . . 0.0 114.765 174.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.11 105.86 17.82 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.927 1.291 . . . . 0.0 113.767 -167.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.5 p -68.59 -20.67 64.52 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.024 1.33 . . . . 0.0 113.101 169.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -59.85 105.6 0.4 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.942 1.297 . . . . 0.0 108.92 167.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -167.16 -24.92 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -172.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -154.49 150.99 22.91 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 125.394 1.477 . . . . 0.0 112.696 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -60.96 135.6 60.33 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.752 2.301 . . . . 0.0 111.436 167.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--O 1.254 1.327 0 C-N-CA 125.747 1.619 . . . . 0.0 112.644 179.453 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 112.114 0.413 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.29 14.5 t-20 65.77 63.54 0.59 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.429 1.892 . . . . 0.0 113.378 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -113.29 163.15 15.19 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 128.383 2.673 . . . . 0.0 104.431 165.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 69.5 m -86.43 91.78 8.63 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.808 1.643 . . . . 0.0 113.378 -165.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.91 -35.67 64.39 Favored 'General case' 0 CA--C 1.554 1.112 0 O-C-N 120.385 -1.447 . . . . 0.0 110.789 170.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.475 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 18.2 mtmt -76.5 -4.33 42.09 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.303 2.241 . . . . 0.0 115.942 178.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -134.72 17.26 3.58 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.719 1.208 . . . . 0.0 112.207 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . 0.457 ' HE2' ' HB2' ' A' ' 19' ' ' LYS . 58.6 ttm -59.63 134.44 57.02 Favored 'General case' 0 C--N 1.345 0.404 0 O-C-N 121.292 -0.88 . . . . 0.0 108.711 170.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 16.5 p -72.02 166.94 21.2 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.468 1.128 . . . . 0.0 112.176 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.69 -31.27 68.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.212 170.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -65.45 -38.36 89.61 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.055 0.843 . . . . 0.0 112.397 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -68.76 -41.57 78.7 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 121.459 -0.776 . . . . 0.0 112.094 172.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -59.46 -47.71 84.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.616 0.644 . . . . 0.0 111.947 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -71.27 -13.26 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.918 0 CA-C-O 118.768 -0.634 . . . . 0.0 112.676 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -90.46 -24.42 20.71 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-N 119.467 1.031 . . . . 0.0 113.547 171.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.03 155.47 36.59 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.38 1.072 . . . . 0.0 112.139 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.567 HD21 ' HD2' ' B' ' 98' ' ' LYS . 36.7 t30 -75.16 139.4 72.45 Favored Pre-proline 0 N--CA 1.478 0.936 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_exo -65.58 -16.5 54.0 Favored 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 121.918 1.745 . . . . 0.0 116.238 -172.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.567 ' HD2' HD21 ' B' ' 96' ' ' ASN . 6.2 mptt -60.08 -61.11 2.85 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.672 -1.268 . . . . 0.0 110.46 168.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.1 -8.99 57.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -177.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -57.31 -40.66 78.35 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 121.02 -1.05 . . . . 0.0 110.911 168.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 45.5 m -57.87 -57.77 23.3 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.39 1.076 . . . . 0.0 113.113 -179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -53.78 -40.54 79.73 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 124.12 3.213 . . . . 0.0 115.791 172.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.5 p -76.8 -36.56 26.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 CA-C-N 120.717 1.599 . . . . 0.0 113.355 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.02 -29.48 69.74 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.755 0.822 . . . . 0.0 111.03 172.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.518 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 67.5 t90 -80.06 -53.05 7.08 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 117.869 -1.062 . . . . 0.0 112.772 169.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.518 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.17 -30.05 70.44 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 117.909 -1.516 . . . . 0.0 111.305 -168.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -58.56 -34.5 71.12 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.705 0.802 . . . . 0.0 112.896 171.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -78.87 -17.39 55.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.442 1.897 . . . . 0.0 114.468 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . 0.446 ' CE1' HD21 ' B' ' 154' ' ' ASN . 0.2 OUTLIER -131.12 -19.86 2.8 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -173.235 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 63.76 160.25 0.09 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 129.797 3.239 . . . . 0.0 117.443 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -73.46 29.33 0.07 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.155 2.182 . . . . 0.0 114.44 178.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 t -78.63 177.72 8.39 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.505 1.922 . . . . 0.0 113.509 -173.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . 0.404 HG23 HG23 ' A' ' 42' ' ' THR . 65.9 t -101.29 132.05 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.934 1.694 . . . . 0.0 106.475 168.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -75.85 153.94 36.47 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 115.071 1.508 . . . . 0.0 115.071 -167.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -145.62 155.9 43.32 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.501 1.521 . . . . 0.0 112.836 -169.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.01 -106.53 1.95 Allowed Glycine 0 CA--C 1.534 1.265 0 C-N-CA 123.763 0.697 . . . . 0.0 111.82 -174.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.99 -155.13 7.52 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 124.621 1.105 . . . . 0.0 113.547 172.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -122.03 22.26 10.33 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.196 1.399 . . . . 0.0 112.537 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 11.4 p -75.0 42.13 0.17 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.853 2.061 . . . . 0.0 115.353 -170.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 34.6 m -65.37 -17.67 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.499 1.12 . . . . 0.0 111.263 167.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -55.46 155.71 5.13 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 127.609 2.364 . . . . 0.0 112.163 167.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 52.3 mt -65.21 121.94 15.94 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.62 -0.675 . . . . 0.0 110.179 168.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -90.87 161.1 15.38 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.128 1.371 . . . . 0.0 109.697 175.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -64.12 -26.25 68.45 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 120.31 -1.494 . . . . 0.0 112.29 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 35.4 m -63.99 -41.44 97.52 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 121.517 -0.739 . . . . 0.0 111.457 169.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -62.77 -50.94 69.06 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.574 1.079 . . . . 0.0 110.129 174.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.2 mt -56.83 -31.53 64.83 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.812 0.845 . . . . 0.0 112.544 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 38.1 m -80.71 -35.98 32.82 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.928 0.891 . . . . 0.0 112.144 174.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -81.73 -30.01 32.66 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.93 -40.51 72.4 Favored Pre-proline 0 CA--C 1.555 1.148 0 CA-C-N 120.525 1.511 . . . . 0.0 113.723 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -74.05 -37.46 2.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 CA-C-N 122.067 1.774 . . . . 0.0 113.632 169.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt -67.68 -30.27 69.75 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 120.372 -1.455 . . . . 0.0 114.181 -174.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -67.64 -24.22 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.159 0.584 . . . . 0.0 112.379 173.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 48.9 mt -72.87 -53.16 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 124.209 1.004 . . . . 0.0 109.734 172.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -55.26 -53.74 52.24 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.469 0.707 . . . . 0.0 110.967 176.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -63.81 -24.96 67.96 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 121.191 -0.943 . . . . 0.0 112.816 -177.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -78.82 -47.62 16.31 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.648 1.113 . . . . 0.0 112.314 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -25.28 67.94 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 120.93 1.695 . . . . 0.0 113.463 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 21.8 mtpp -74.81 -26.85 60.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.455 1.502 . . . . 0.0 114.959 169.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 33.9 m-80 -135.85 62.49 47.39 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.331 1.453 . . . . 0.0 110.871 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.47 -16.0 39.42 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 123.577 2.851 . . . . 0.0 114.773 -171.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.9 pm0 -78.39 -23.88 46.58 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.973 1.709 . . . . 0.0 114.283 -177.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? -67.1 164.42 18.0 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.27 1.428 . . . . 0.0 112.901 -173.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -91.37 131.04 37.12 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 168.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.6 tp -46.03 -37.99 7.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.739 1.616 . . . . 0.0 113.728 179.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.475 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 7.2 m-85 -78.31 -8.64 58.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.0 p -65.44 -24.3 67.15 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 120.786 -1.197 . . . . 0.0 111.636 168.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -72.97 -2.48 21.18 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -80.04 -32.11 39.51 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.663 1.12 . . . . 0.0 111.632 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -68.33 -30.85 69.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.744 0.818 . . . . 0.0 112.078 -169.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -73.34 -28.56 62.13 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.258 1.823 . . . . 0.0 115.253 169.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -133.69 80.1 1.85 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.189 1.395 . . . . 0.0 114.021 -165.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 45.8 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 114.772 -1.104 . . . . 0.0 108.966 168.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . 0.446 HD21 ' CE1' ' B' ' 109' ' ' HIS . 35.0 p-10 -70.15 -54.18 14.03 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.22 1.563 . . . . 0.0 115.22 -168.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -161.68 -34.65 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.72 1.608 . . . . 0.0 114.429 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -65.11 147.81 98.29 Favored Pre-proline 0 CA--C 1.552 1.057 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -170.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -60.0 151.5 71.61 Favored 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 123.293 2.662 . . . . 0.0 114.091 175.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 125.816 1.646 . . . . 0.0 113.191 178.084 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.979 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.0 t30 57.23 46.68 18.28 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.932 1.693 . . . . 0.0 114.428 179.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.407 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 19.8 mm-40 -58.45 -26.36 63.25 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.201 167.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 t 100.24 105.67 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.261 3.024 . . . . 0.0 115.138 169.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -63.79 -26.28 68.56 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.073 -1.642 . . . . 0.0 111.01 169.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.457 ' HD3' ' CE1' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -67.15 -20.26 65.72 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.961 2.104 . . . . 0.0 113.782 175.452 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -115.58 5.2 14.31 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.937 1.295 . . . . 0.0 113.29 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 48.1 ttm -62.62 123.24 17.84 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.017 -1.052 . . . . 0.0 109.977 173.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -79.17 155.4 28.67 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.227 -0.921 . . . . 0.0 110.695 176.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -61.11 -34.97 75.8 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 120.604 -1.31 . . . . 0.0 112.831 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.3 tp60 -61.62 -33.38 73.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 118.95 0.796 . . . . 0.0 112.95 172.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -78.63 -37.36 42.34 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.994 1.318 . . . . 0.0 111.607 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -59.81 -49.64 76.91 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.613 0.765 . . . . 0.0 112.409 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.6 pt -68.38 -5.87 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.324 1.05 . . . . 0.0 112.896 177.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -105.16 -8.84 18.13 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.412 1.485 . . . . 0.0 113.494 174.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.36 159.87 31.8 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 120.957 -1.089 . . . . 0.0 111.203 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -67.64 130.08 93.23 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.039 -1.038 . . . . 0.0 112.187 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.79 -16.99 12.48 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 124.809 3.673 . . . . 0.0 116.396 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HG3' ' C ' ' B' ' 82' ' ' GLU . 11.9 mttt -64.4 -67.62 0.42 Allowed 'General case' 0 C--N 1.347 0.461 0 C-N-CA 126.813 2.045 . . . . 0.0 108.649 166.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.84 -10.45 59.51 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.4 ttt -59.38 -34.91 73.0 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 172.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.272 19.1 m -66.3 -52.65 36.24 Favored Pre-proline 0 N--CA 1.481 1.081 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -50.98 -43.95 44.81 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.368 2.712 . . . . 0.0 115.469 169.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.3 p -73.04 -38.45 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-N 119.218 0.917 . . . . 0.0 113.095 177.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.21 -20.51 66.47 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.254 1.022 . . . . 0.0 111.783 174.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.474 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 58.4 t90 -88.65 -51.2 5.81 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.81 168.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.426 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 1.9 t90 -69.2 -31.08 69.44 Favored 'General case' 0 C--N 1.351 0.63 0 CA-C-N 120.025 1.284 . . . . 0.0 112.252 -168.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.7 tmm? -63.92 -43.84 94.7 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.625 0.77 . . . . 0.0 110.995 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -71.23 -34.39 70.75 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.592 1.157 . . . . 0.0 112.802 -173.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -97.3 -2.31 42.84 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 173.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.407 ' HG2' ' H ' ' A' ' 32' ' ' GLU . 7.8 tt0 61.69 173.32 0.12 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 125.825 1.65 . . . . 0.0 112.989 -168.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.407 ' H ' ' HG2' ' A' ' 31' ' ' GLU . 45.7 mt-10 -76.37 48.48 0.53 Allowed 'General case' 0 N--CA 1.478 0.957 0 O-C-N 120.518 -1.364 . . . . 0.0 112.991 -175.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.5 t -148.48 173.94 12.6 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.553 1.941 . . . . 0.0 112.074 -173.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.409 ' H ' HG13 ' B' ' 120' ' ' VAL . 53.8 t -125.01 155.04 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 126.591 1.956 . . . . 0.0 107.82 169.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -61.58 160.1 11.97 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.74 1.385 . . . . 0.0 114.74 -168.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -81.39 4.37 21.09 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.081 1.352 . . . . 0.0 114.558 -169.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 178.6 -36.72 0.08 OUTLIER Glycine 0 CA--C 1.539 1.542 0 C-N-CA 125.127 1.346 . . . . 0.0 113.755 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -71.28 169.82 48.87 Favored Glycine 0 CA--C 1.54 1.634 0 CA-C-N 117.887 0.843 . . . . 0.0 113.4 169.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -142.06 -0.21 1.32 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 -172.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -77.94 54.79 1.34 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.221 1.408 . . . . 0.0 112.371 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 18.9 m -61.47 -11.74 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 125.555 1.542 . . . . 0.0 113.068 172.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -39.78 141.25 0.44 Allowed 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.59 2.356 . . . . 0.0 111.759 168.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 30.4 mt -70.07 76.39 0.5 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.881 0.848 . . . . 0.0 109.913 168.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -69.41 175.61 3.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.737 2.015 . . . . 0.0 112.411 177.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -68.65 -23.03 64.37 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.742 -1.849 . . . . 0.0 113.771 -172.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.3 m -71.1 -42.0 69.86 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.255 0.934 . . . . 0.0 110.483 169.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.9 -49.1 77.89 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.548 -0.72 . . . . 0.0 111.795 170.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.7 mt -65.07 -22.3 66.94 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.129 -0.982 . . . . 0.0 111.812 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.9 m -79.17 -36.87 39.66 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.172 0.989 . . . . 0.0 111.67 169.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -82.65 -33.59 27.74 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.551 -1.343 . . . . 0.0 113.876 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.43 -42.38 87.28 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 117.536 -1.221 . . . . 0.0 112.696 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.41 -37.93 7.0 Favored 'Trans proline' 0 C--N 1.355 0.874 0 CA-C-N 122.119 1.793 . . . . 0.0 113.385 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.8 mmtt -67.02 -34.45 77.75 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.149 -1.594 . . . . 0.0 113.68 -176.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.6 m -67.52 -16.2 20.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 173.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 23.7 mt -90.58 -50.73 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.221 1.408 . . . . 0.0 110.687 172.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.28 -39.14 78.46 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.309 1.043 . . . . 0.0 111.482 177.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -70.14 -24.29 63.15 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.14 -0.975 . . . . 0.0 111.52 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.82 -44.8 17.91 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.999 0.92 . . . . 0.0 112.031 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -27.69 69.37 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 120.666 1.575 . . . . 0.0 113.526 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -69.56 -35.12 75.11 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 168.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -130.04 65.78 76.21 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.682 1.193 . . . . 0.0 112.263 -178.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -55.71 -14.43 10.43 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.53 2.82 . . . . 0.0 117.033 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -84.85 -21.41 29.82 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.375 1.47 . . . . 0.0 113.65 -177.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -70.07 158.32 35.92 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.327 1.051 . . . . 0.0 111.981 -172.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -94.91 133.37 38.72 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.4 tp -49.64 -42.81 46.07 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 115.458 1.651 . . . . 0.0 115.458 -168.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.457 ' CE1' ' HD3' ' A' ' 6' ' ' LYS . 7.5 m-85 -75.0 -8.56 56.86 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -178.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 69.0 p -60.41 -27.37 67.4 Favored 'General case' 0 N--CA 1.481 1.083 0 O-C-N 120.349 -1.47 . . . . 0.0 111.517 168.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -72.87 -3.85 28.22 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.76 1.224 . . . . 0.0 113.7 177.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -79.73 -30.95 41.05 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.338 0.972 . . . . 0.0 111.747 168.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -69.71 -26.03 64.15 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.72 1.208 . . . . 0.0 112.243 -170.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -76.88 -31.82 57.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.843 1.657 . . . . 0.0 114.872 174.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -97.81 110.66 23.19 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.304 1.042 . . . . 0.0 113.658 -167.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.4 m -133.26 106.94 7.84 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.709 1.203 . . . . 0.0 110.913 170.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -143.47 -52.07 0.35 Allowed 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.99 -4.66 57.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.198 1.925 . . . . 0.0 116.198 -166.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -143.76 150.02 48.69 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 124.981 1.312 . . . . 0.0 113.634 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -70.98 161.65 45.37 Favored 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 123.233 2.622 . . . . 0.0 112.152 170.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 . . . . . 0 C--O 1.249 1.055 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 174.873 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.982 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 49.1 t30 57.86 50.14 10.93 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.795 1.638 . . . . 0.0 114.226 177.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.407 ' C ' ' HG3' ' A' ' 19' ' ' LYS . 34.9 mm-40 -63.39 -16.87 61.79 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 0.0 113.139 168.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.1 t 101.62 95.09 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 129.68 3.192 . . . . 0.0 116.305 168.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.22 -37.39 77.38 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 120.339 -1.476 . . . . 0.0 112.202 172.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.3 ptpt -76.01 -13.22 60.23 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -107.92 7.26 27.91 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.656 1.183 . . . . 0.0 113.051 170.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 40.5 ttm -62.55 128.66 37.02 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.795 -1.19 . . . . 0.0 109.829 173.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.8 t -77.17 154.55 33.04 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 120.929 -1.107 . . . . 0.0 110.744 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.16 -33.67 74.95 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.225 -1.547 . . . . 0.0 113.277 -174.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -30.79 71.15 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 119.171 0.896 . . . . 0.0 112.22 173.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -76.54 -37.23 56.99 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.677 1.191 . . . . 0.0 111.504 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.25 -49.63 76.33 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.418 -0.801 . . . . 0.0 113.022 175.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 9.0 pt -66.61 -8.86 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.946 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -102.08 -12.14 18.33 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 126.114 1.766 . . . . 0.0 114.015 173.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.51 157.73 37.35 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.616 1.098 . . . . 0.0 111.45 176.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.449 HD21 ' CD ' ' B' ' 98' ' ' LYS . 1.7 t-20 -57.51 134.66 82.06 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 124.421 1.088 . . . . 0.0 113.458 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 13.6 Cg_exo -75.92 -6.32 17.3 Favored 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 121.483 1.456 . . . . 0.0 115.176 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.449 ' CD ' HD21 ' B' ' 96' ' ' ASN . 6.3 mptt -70.04 -55.28 9.94 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.454 1.479 . . . . 0.0 109.207 168.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.72 -9.61 55.53 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -178.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.2 ttm -56.06 -30.91 62.64 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 120.243 -1.536 . . . . 0.0 112.731 169.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.7 m -66.05 -57.2 13.96 Favored Pre-proline 0 N--CA 1.482 1.153 0 CA-C-O 117.813 -1.089 . . . . 0.0 112.603 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -53.43 -36.43 79.41 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.916 3.077 . . . . 0.0 114.113 169.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 61.7 t -63.06 -53.29 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 CA-C-N 119.275 0.943 . . . . 0.0 111.196 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.81 -33.16 75.22 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.235 1.014 . . . . 0.0 111.257 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.491 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 65.9 t90 -69.37 -53.68 18.29 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 117.649 -1.167 . . . . 0.0 112.22 169.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.491 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.6 t90 -65.09 -32.35 74.02 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.03 -1.468 . . . . 0.0 111.998 -167.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 62.8 ttp -53.63 -46.03 70.36 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.544 1.137 . . . . 0.0 111.893 169.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -76.19 -21.54 56.37 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.015 1.326 . . . . 0.0 113.841 -178.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -149.05 81.41 1.43 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.417 1.087 . . . . 0.0 110.969 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.79 161.14 29.12 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 117.044 2.238 . . . . 0.0 117.044 -167.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.44 17.92 0.25 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 115.491 1.663 . . . . 0.0 115.491 172.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 40.4 p -73.67 38.26 0.1 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.341 1.857 . . . . 0.0 113.994 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . 0.267 46.0 t 65.01 133.1 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 130.971 3.709 . . . . 0.0 113.348 -178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -81.54 60.67 4.63 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -166.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt -63.06 -10.5 14.54 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.792 2.037 . . . . 0.0 115.985 -173.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -70.01 -14.17 70.49 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 124.719 1.152 . . . . 0.0 115.127 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 79.88 64.23 1.9 Allowed Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.846 1.323 . . . . 0.0 113.139 176.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.351 4.7 p-10 48.44 38.62 11.14 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 174.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 27.5 p -64.49 -30.38 71.41 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.008 -1.058 . . . . 0.0 111.53 166.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . 0.409 HG13 ' H ' ' A' ' 34' ' ' VAL . 83.9 t 63.73 127.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 130.776 3.63 . . . . 0.0 117.208 172.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . 0.255 1.2 t 54.35 -177.38 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.767 2.827 . . . . 0.0 117.708 167.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 2.3 pp -67.42 166.46 14.54 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 128.417 2.687 . . . . 0.0 114.577 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -133.95 -178.82 5.2 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.817 2.047 . . . . 0.0 111.44 176.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -65.14 -24.38 67.39 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.637 -1.289 . . . . 0.0 114.021 -172.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 52.2 m -65.57 -38.69 90.28 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 121.265 -0.897 . . . . 0.0 111.062 169.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -66.2 -44.14 84.74 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.836 1.198 . . . . 0.0 110.655 175.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.4 mt -57.07 -26.29 60.15 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 46.3 m -83.54 -32.41 25.88 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.918 1.287 . . . . 0.0 112.597 173.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 25.0 mm100 -78.71 -34.51 45.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.775 -1.203 . . . . 0.0 113.447 177.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -53.49 -38.26 60.04 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 117.379 -1.296 . . . . 0.0 113.474 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -75.6 -37.55 1.7 Allowed 'Trans proline' 0 CA--C 1.542 0.91 0 CA-C-N 122.246 1.838 . . . . 0.0 113.18 168.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -64.02 -33.52 75.93 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 120.593 -1.317 . . . . 0.0 113.766 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 34.6 m -69.53 -26.4 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 123.575 0.75 . . . . 0.0 112.789 178.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 52.3 mt -69.42 -50.1 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.632 0.773 . . . . 0.0 109.323 171.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -59.4 -42.49 91.9 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.055 0.942 . . . . 0.0 111.878 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -68.57 -25.7 65.03 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 120.735 -1.228 . . . . 0.0 112.117 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.54 -45.38 25.58 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.288 -0.883 . . . . 0.0 111.829 176.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -27.29 68.77 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-N 120.459 1.481 . . . . 0.0 113.652 174.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -71.11 -36.04 72.0 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 168.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -127.51 62.62 55.61 Favored Pre-proline 0 CA--C 1.543 0.691 0 C-N-CA 125.234 1.414 . . . . 0.0 110.727 -176.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.83 -13.63 27.8 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.521 2.814 . . . . 0.0 114.786 -172.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 17.9 pm0 -81.69 -23.66 36.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.132 1.773 . . . . 0.0 114.304 -178.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.3 mmpt? -66.26 156.93 32.86 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.84 1.256 . . . . 0.0 112.072 -175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.9 t30 -89.57 131.78 35.41 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 172.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.1 tp -48.17 -52.35 21.11 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -168.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -68.88 -8.03 40.2 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -174.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 72.6 p -57.59 -27.29 62.59 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 120.539 -1.351 . . . . 0.0 111.118 168.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -71.22 -3.86 22.54 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.469 1.508 . . . . 0.0 114.48 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.61 -34.55 40.6 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.772 1.169 . . . . 0.0 111.655 167.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.75 -31.41 66.63 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.018 1.327 . . . . 0.0 112.392 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -66.06 -30.31 70.81 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.306 1.442 . . . . 0.0 114.456 173.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.47 -59.44 1.7 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -167.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 66.8 m 32.34 56.14 0.37 Allowed 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 126.609 1.963 . . . . 0.0 114.73 -169.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -69.26 -23.06 63.81 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -173.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -142.97 179.01 7.28 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.88 1.272 . . . . 0.0 112.389 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . 0.313 0.4 OUTLIER 55.91 150.56 0.05 OUTLIER Pre-proline 0 CA--C 1.56 1.331 0 C-N-CA 130.931 3.692 . . . . 0.0 116.505 -169.177 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.78 155.14 50.66 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.231 2.62 . . . . 0.0 114.101 173.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.345 0 C-N-CA 125.94 1.696 . . . . 0.0 112.802 176.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.05 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.348 9.1 t-20 69.97 30.17 3.71 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 116.126 1.899 . . . . 0.0 116.126 174.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.86 160.53 32.01 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 105.12 -2.178 . . . . 0.0 105.12 160.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 t -104.73 116.1 31.45 Favored 'General case' 0 CA--C 1.505 -0.756 0 O-C-N 120.585 -1.322 . . . . 0.0 112.313 -166.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.14 -32.82 73.36 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.091 167.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.429 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.4 mtmt -63.24 -28.96 70.39 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.504 1.922 . . . . 0.0 114.209 -179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -113.59 10.44 18.07 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.236 1.414 . . . . 0.0 112.647 177.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.458 ' HE2' ' HB2' ' B' ' 98' ' ' LYS . 12.7 ttm -64.29 123.43 19.12 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 120.726 -1.234 . . . . 0.0 108.616 170.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.8 t -79.36 157.85 27.55 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.117 -0.989 . . . . 0.0 110.695 -174.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -61.53 -35.6 78.18 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.587 -1.32 . . . . 0.0 112.84 -174.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.6 tp60 -61.24 -33.44 73.51 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 172.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -79.9 -38.48 32.47 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.12 1.368 . . . . 0.0 111.67 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -59.19 -49.65 77.04 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 123.991 0.917 . . . . 0.0 112.705 176.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.0 pt -67.71 -5.15 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 C-N-CA 124.362 1.065 . . . . 0.0 112.641 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -107.26 -6.83 17.01 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.325 1.45 . . . . 0.0 113.707 173.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.02 160.82 29.44 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 120.915 -1.115 . . . . 0.0 110.94 175.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.445 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 41.9 t-20 -64.78 131.08 95.05 Favored Pre-proline 0 N--CA 1.483 1.224 0 O-C-N 121.157 -0.964 . . . . 0.0 111.999 -176.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 29.7 Cg_exo -60.61 -16.53 43.54 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.437 2.758 . . . . 0.0 114.969 -178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -60.27 -67.39 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.717 1.607 . . . . 0.0 110.161 168.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.12 -3.74 53.02 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -176.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.6 ttt -57.71 -40.46 79.57 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 169.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.6 m -64.83 -54.18 37.35 Favored Pre-proline 0 N--CA 1.481 1.125 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_endo -48.97 -44.41 32.52 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.732 2.955 . . . . 0.0 115.886 169.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 12.1 p -72.5 -42.25 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.28 -35.69 70.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 122.877 0.471 . . . . 0.0 110.229 171.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 75.1 t90 -76.3 -49.84 15.9 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.587 177.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.422 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 1.4 t90 -64.75 -25.33 67.88 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 120.383 1.447 . . . . 0.0 111.264 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -66.92 -50.71 61.52 Favored 'General case' 0 N--CA 1.444 -0.737 0 C-N-CA 125.422 1.489 . . . . 0.0 111.693 168.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.05 -37.57 87.72 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.543 1.137 . . . . 0.0 113.765 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -121.53 96.7 5.18 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.844 1.658 . . . . 0.0 109.164 174.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.95 149.84 35.24 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -177.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -76.34 -3.54 37.34 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.589 1.956 . . . . 0.0 114.115 175.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 41.5 p -74.16 25.72 0.08 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.524 1.93 . . . . 0.0 115.624 -168.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 57.7 t 59.35 133.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 128.875 2.87 . . . . 0.0 115.018 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -76.55 158.29 31.32 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.7 -1.25 . . . . 0.0 113.171 -178.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -142.64 49.58 1.49 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.582 1.553 . . . . 0.0 112.067 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 170.43 -8.62 0.04 OUTLIER Glycine 0 CA--C 1.542 1.738 0 N-CA-C 116.389 1.316 . . . . 0.0 116.389 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -173.85 -173.69 40.2 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 119.447 1.623 . . . . 0.0 114.332 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.6 p-10 -113.87 47.43 1.19 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 127.886 2.474 . . . . 0.0 110.658 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.88 24.23 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 128.8 2.84 . . . . 0.0 117.166 -168.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.21 -21.44 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 O-C-N 120.367 -1.458 . . . . 0.0 112.086 170.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 12.6 p -56.32 141.64 40.92 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.817 1.647 . . . . 0.0 112.826 174.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.9 mt -92.54 150.31 20.83 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.119 0.568 . . . . 0.0 110.263 169.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 24.9 p30 -145.43 170.78 15.68 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.801 1.241 . . . . 0.0 111.527 -173.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.22 -27.27 67.1 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 120.837 -1.164 . . . . 0.0 113.489 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 15.3 m -63.62 -51.99 62.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.967 0.803 . . . . 0.0 110.133 169.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -54.83 -49.55 70.77 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.354 0.525 . . . . 0.0 110.365 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 79.0 mt -61.22 -33.61 73.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.892 0.877 . . . . 0.0 112.412 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.2 m -72.9 -35.91 67.19 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.424 1.09 . . . . 0.0 111.404 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm100 -78.52 -24.06 45.94 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 117.759 -1.115 . . . . 0.0 113.134 -178.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.95 -47.93 95.45 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 120.352 1.433 . . . . 0.0 112.399 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.48 -34.1 21.09 Favored 'Trans proline' 0 C--N 1.354 0.864 0 CA-C-N 121.865 1.702 . . . . 0.0 113.342 171.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.7 mmtt -67.58 -34.33 76.82 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.502 1.501 . . . . 0.0 114.057 -177.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.5 m -69.13 -20.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-N 118.77 0.714 . . . . 0.0 112.79 173.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 27.8 mt -83.83 -50.37 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.501 1.121 . . . . 0.0 110.781 171.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -58.56 -39.07 79.25 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.9 0.88 . . . . 0.0 111.783 176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -69.23 -28.81 66.68 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.434 0.561 . . . . 0.0 111.627 177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.7 m -77.68 -46.72 21.1 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.293 -0.88 . . . . 0.0 112.921 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -28.96 67.55 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 120.85 1.659 . . . . 0.0 114.334 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 14.1 ptpt -75.0 -30.23 61.08 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 173.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -134.13 75.4 65.88 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 125.098 1.359 . . . . 0.0 112.137 172.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -59.27 -9.59 8.79 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.405 3.403 . . . . 0.0 117.297 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -81.9 -21.68 37.25 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.351 1.46 . . . . 0.0 113.129 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -68.76 160.35 30.58 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.809 1.244 . . . . 0.0 111.387 -175.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -83.7 152.04 24.94 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.619 -0.676 . . . . 0.0 110.759 173.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.9 tp -67.5 -35.4 79.06 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.08 -1.012 . . . . 0.0 113.357 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.429 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.8 m-85 -90.91 -23.85 20.37 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -169.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -58.83 -23.6 60.8 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.366 -0.834 . . . . 0.0 111.675 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -61.46 -4.77 1.41 Allowed 'General case' 0 CA--C 1.539 0.548 0 O-C-N 119.692 -1.88 . . . . 0.0 113.696 172.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -35.17 67.05 Favored 'General case' 0 C--O 1.224 -0.269 0 O-C-N 120.957 -1.089 . . . . 0.0 111.945 167.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.77 -30.51 71.52 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.916 0.886 . . . . 0.0 113.249 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.416 ' HG2' ' H ' ' A' ' 72' ' ' GLN . 8.9 pt20 -73.56 -23.14 59.93 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.729 1.612 . . . . 0.0 114.395 173.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.1 14.95 18.38 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.0 2.12 . . . . 0.0 116.015 -166.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 57.9 m -66.77 81.01 0.11 Allowed 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -176.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -123.86 -1.39 8.38 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 127.399 2.28 . . . . 0.0 113.002 169.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -71.97 -41.97 67.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 128.222 2.609 . . . . 0.0 111.998 170.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -150.52 151.84 31.61 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.421 1.889 . . . . 0.0 112.336 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -72.01 157.93 53.5 Favored 'Trans proline' 0 N--CA 1.44 -1.654 0 C-N-CA 122.633 2.222 . . . . 0.0 110.668 167.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 27.7 m120 . . . . . 0 C--O 1.276 2.487 0 C-N-CA 125.624 1.569 . . . . 0.0 108.26 173.332 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.154 0 CA-C-O 120.892 0.377 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.266 0.6 OUTLIER 67.72 54.12 0.66 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 123.22 1.486 . . . . 0.0 113.029 173.201 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -97.5 157.63 15.91 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 103.795 -2.668 . . . . 0.0 103.795 165.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 67.2 m -86.44 86.52 7.34 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 125.019 1.328 . . . . 0.0 113.416 -164.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.31 53.53 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 120.084 1.311 . . . . 0.0 111.033 171.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.409 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 9.4 ptpt -77.67 -0.51 26.96 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.958 2.103 . . . . 0.0 116.411 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -136.45 19.07 3.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.979 1.312 . . . . 0.0 112.233 170.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 57.4 ttm -60.75 123.22 16.86 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.899 -1.126 . . . . 0.0 108.192 169.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.9 t -77.76 153.87 32.49 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.577 -0.702 . . . . 0.0 109.963 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -61.51 -33.48 73.88 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 120.805 -1.185 . . . . 0.0 112.991 -173.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.4 tp60 -65.94 -30.99 71.66 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.024 0.829 . . . . 0.0 112.975 173.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 59.7 tt0 -77.33 -37.89 51.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.976 1.311 . . . . 0.0 111.101 173.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -62.78 -48.98 76.78 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.446 -0.784 . . . . 0.0 112.702 177.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.6 pt -69.21 -4.11 3.44 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 123.597 0.759 . . . . 0.0 112.977 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.8 -12.62 16.21 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.145 1.778 . . . . 0.0 114.124 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 159.78 32.87 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 119.763 1.165 . . . . 0.0 110.849 173.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 51.8 t-20 -66.66 129.09 94.11 Favored Pre-proline 0 N--CA 1.483 1.206 0 O-C-N 121.384 -0.822 . . . . 0.0 111.165 -177.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 31.2 Cg_exo -59.77 -18.17 47.19 Favored 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 122.927 2.418 . . . . 0.0 114.786 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.458 ' HB2' ' HE2' ' A' ' 8' ' ' MET . 32.1 mttp -56.14 -66.76 0.38 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 126.184 1.793 . . . . 0.0 109.495 168.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.5 -7.22 59.55 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 17.3 ttm -56.82 -43.27 80.86 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.958 -1.089 . . . . 0.0 111.544 169.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 60.3 m -55.61 -57.48 20.88 Favored Pre-proline 0 N--CA 1.484 1.228 0 CA-C-O 118.036 -0.983 . . . . 0.0 113.551 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -52.93 -43.39 57.06 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 124.21 3.273 . . . . 0.0 115.621 172.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 10.2 p -73.92 -39.24 51.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 120.235 1.38 . . . . 0.0 113.263 178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.29 -29.89 69.12 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.086 0.954 . . . . 0.0 111.061 172.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.51 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 61.1 t90 -79.37 -53.49 6.87 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 117.441 -1.266 . . . . 0.0 112.353 169.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.51 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.5 t90 -64.55 -29.9 70.93 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 120.903 1.683 . . . . 0.0 112.65 -167.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.1 tmm? -61.36 -51.28 69.44 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.355 1.062 . . . . 0.0 111.415 171.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.22 -27.98 65.95 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.671 1.588 . . . . 0.0 111.666 -178.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . 0.485 ' CG ' HD22 ' B' ' 154' ' ' ASN . 14.6 t60 -148.24 96.19 2.58 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.504 1.122 . . . . 0.0 111.72 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.0 166.62 21.84 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -171.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.42 1.19 1.21 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.776 1.63 . . . . 0.0 115.378 171.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 13.5 t -58.64 144.23 43.88 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 121.085 -1.009 . . . . 0.0 111.845 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 79.6 t -66.03 131.86 31.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 O-C-N 121.65 -0.656 . . . . 0.0 111.513 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 19.8 m-30 -67.74 167.05 14.03 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.989 1.316 . . . . 0.0 113.358 -176.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -76.0 -0.84 23.06 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 155.52 -23.42 0.57 Allowed Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.139 1.352 . . . . 0.0 114.618 173.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -77.71 168.41 54.27 Favored Glycine 0 CA--C 1.538 1.51 0 CA-C-N 118.211 1.006 . . . . 0.0 115.08 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 32.9 p30 -128.15 13.16 6.68 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.654 1.982 . . . . 0.0 113.113 174.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 7.0 p -80.37 61.14 4.03 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 127.108 2.163 . . . . 0.0 112.255 -172.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.79 10.91 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -176.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.0 t -76.7 174.11 10.83 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.252 0.621 . . . . 0.0 109.421 166.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 79.5 mt -86.95 125.09 33.82 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.011 -1.055 . . . . 0.0 112.542 -178.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -79.2 166.06 22.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.617 1.167 . . . . 0.0 110.546 169.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -70.79 -23.3 62.36 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 120.884 -1.135 . . . . 0.0 113.741 -173.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 98.1 m -65.02 -51.3 62.38 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.024 0.829 . . . . 0.0 110.396 169.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -54.36 -55.52 27.75 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 118.913 0.778 . . . . 0.0 110.489 174.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.7 mt -54.27 -36.75 63.96 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 33.9 m -77.38 -35.03 54.79 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.166 0.586 . . . . 0.0 111.852 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.7 mm100 -79.44 -23.61 43.02 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 117.57 -1.205 . . . . 0.0 114.071 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.9 mm -53.09 -47.21 96.61 Favored Pre-proline 0 N--CA 1.483 1.182 0 CA-C-N 120.757 1.617 . . . . 0.0 112.406 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.53 -32.0 12.8 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.663 1.575 . . . . 0.0 113.759 172.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.47 -35.68 80.87 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.877 -1.139 . . . . 0.0 113.171 -178.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 31.8 m -69.33 -26.39 31.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 118.476 0.58 . . . . 0.0 112.341 174.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.08 -51.1 25.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.334 0.654 . . . . 0.0 110.334 172.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -52.49 -47.86 66.29 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.841 0.856 . . . . 0.0 112.075 173.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -69.5 -23.37 63.61 Favored 'General case' 0 CA--C 1.546 0.796 0 O-C-N 121.175 -0.953 . . . . 0.0 112.311 -175.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -78.43 -48.23 15.87 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.277 -0.89 . . . . 0.0 112.049 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -27.25 69.04 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.929 1.241 . . . . 0.0 113.646 174.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -70.94 -33.54 70.6 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 168.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -128.22 63.19 62.0 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.171 1.388 . . . . 0.0 111.029 -176.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.2 -14.77 20.78 Favored 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.142 3.228 . . . . 0.0 116.608 -169.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -89.41 -18.23 27.22 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 -178.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.7 mmpt? -66.45 158.96 28.16 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.573 1.149 . . . . 0.0 112.033 -176.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -88.02 130.75 34.88 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 62.2 tp -46.14 -37.03 6.46 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.332 1.453 . . . . 0.0 114.027 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.409 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.5 m-85 -78.76 -9.78 59.55 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 -178.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.7 p -64.77 -24.28 67.51 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 120.603 -1.311 . . . . 0.0 111.671 168.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.3 m-30 -73.41 -3.72 29.13 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 114.191 1.182 . . . . 0.0 114.191 -177.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -78.89 -35.03 44.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.922 1.289 . . . . 0.0 111.558 167.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -68.34 -32.17 72.09 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.6 1.16 . . . . 0.0 112.39 -169.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -70.12 -29.24 66.14 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 115.007 173.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -108.38 -38.52 5.69 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 116.306 1.965 . . . . 0.0 116.306 -166.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 37.8 m 60.3 -34.88 0.08 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 127.452 2.301 . . . . 0.0 117.085 -170.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . 0.485 HD22 ' CG ' ' B' ' 109' ' ' HIS . 47.0 t30 65.88 162.35 0.15 Allowed 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.683 2.793 . . . . 0.0 115.44 -174.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.19 133.76 47.39 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.46 1.104 . . . . 0.0 111.736 171.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 24.3 mt -117.3 115.99 37.63 Favored Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 124.855 1.262 . . . . 0.0 109.765 -177.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -84.07 137.74 7.52 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.493 2.129 . . . . 0.0 113.6 -169.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 . . . . . 0 C--O 1.251 1.172 0 C-N-CA 127.311 2.244 . . . . 0.0 111.637 178.734 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.939 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.5 t30 55.73 52.67 10.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.865 1.666 . . . . 0.0 114.27 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.402 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 28.2 mm-40 -64.61 -17.17 63.75 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 117.855 -1.069 . . . . 0.0 112.654 167.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.5 m 99.24 92.3 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 129.645 3.178 . . . . 0.0 115.768 167.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.15 -35.92 72.23 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.997 -1.689 . . . . 0.0 112.339 175.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.463 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -73.13 1.59 8.86 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 116.487 2.032 . . . . 0.0 116.487 173.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -126.22 6.6 7.11 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.118 1.367 . . . . 0.0 112.126 168.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.45 ' HE2' ' HB2' ' B' ' 98' ' ' LYS . 35.2 ttm -61.61 126.92 29.06 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 120.752 -1.217 . . . . 0.0 109.725 172.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.4 t -78.53 154.14 30.69 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.327 -0.858 . . . . 0.0 110.197 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -63.0 -33.08 74.65 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 120.8 -1.188 . . . . 0.0 113.132 -174.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -61.88 -32.15 72.49 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 170.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 52.6 tt0 -78.62 -38.26 40.24 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.635 1.174 . . . . 0.0 111.605 175.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -58.13 -50.32 73.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 7.1 pt -67.5 -7.96 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.48 1.112 . . . . 0.0 113.178 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -105.0 -8.58 18.45 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 125.812 1.645 . . . . 0.0 113.615 175.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.34 159.4 33.4 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 121.065 -1.022 . . . . 0.0 110.738 174.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -75.93 137.29 69.52 Favored Pre-proline 0 N--CA 1.483 1.199 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -168.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.56 -14.27 41.55 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.159 2.573 . . . . 0.0 116.486 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -63.31 -61.3 2.44 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 125.449 1.5 . . . . 0.0 108.589 166.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.496 ' HB1' HG21 ' B' ' 103' ' ' VAL . . . -81.93 -10.19 59.35 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 115.418 1.636 . . . . 0.0 115.418 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.8 ttt -58.63 -35.08 71.92 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.4 m -64.73 -54.56 35.03 Favored Pre-proline 0 N--CA 1.483 1.182 0 N-CA-C 114.385 1.254 . . . . 0.0 114.385 -176.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.419 ' HG2' HG22 ' B' ' 103' ' ' VAL . 16.4 Cg_endo -54.71 -36.85 91.27 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.902 2.401 . . . . 0.0 115.739 173.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.52 -38.45 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 119.492 1.042 . . . . 0.0 113.549 175.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.92 -26.41 67.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.876 0.87 . . . . 0.0 111.151 173.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.517 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 70.7 t90 -87.28 -52.4 5.42 Favored 'General case' 0 C--N 1.343 0.304 0 CA-C-O 117.443 -1.265 . . . . 0.0 112.887 169.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.517 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.5 t90 -67.64 -24.72 65.48 Favored 'General case' 0 C--N 1.348 0.543 0 CA-C-N 121.297 1.862 . . . . 0.0 112.25 -167.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -63.85 -50.16 69.97 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.215 1.006 . . . . 0.0 111.349 169.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.45 -22.34 65.5 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.216 1.406 . . . . 0.0 111.852 -176.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -93.02 -36.53 12.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.224 1.81 . . . . 0.0 113.53 173.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.252 30.5 tt0 53.0 61.65 3.08 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 129.213 3.005 . . . . 0.0 114.621 -176.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . 0.257 13.6 pt-20 46.41 17.49 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 117.975 2.583 . . . . 0.0 117.975 168.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 t -74.9 168.43 19.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.721 1.209 . . . . 0.0 112.578 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.9 p -93.67 132.14 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 C-N-CA 124.554 1.142 . . . . 0.0 110.595 175.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.99 139.09 30.99 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 125.077 1.351 . . . . 0.0 111.417 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 3.9 ptpt -145.91 149.13 33.65 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.701 1.201 . . . . 0.0 112.138 -169.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.73 -71.95 0.68 Allowed Glycine 0 CA--C 1.536 1.404 0 C-N-CA 124.939 1.257 . . . . 0.0 113.188 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.88 169.75 54.35 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.891 1.234 . . . . 0.0 113.893 174.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -121.56 13.85 10.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.065 1.746 . . . . 0.0 113.788 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 37.5 p -73.13 24.31 0.06 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.689 2.107 . . . . 0.0 116.689 -169.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.5 m -66.94 -0.81 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.76 1.224 . . . . 0.0 112.313 166.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . 0.262 17.1 p -57.59 -23.01 48.49 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 128.625 2.77 . . . . 0.0 114.683 167.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.7 mp 72.72 84.55 0.12 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 128.931 2.893 . . . . 0.0 109.0 -164.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -66.42 172.89 3.64 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.888 169.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -64.98 -18.56 65.39 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 120.626 -1.296 . . . . 0.0 114.019 -170.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 96.7 m -65.21 -45.26 85.47 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.986 1.266 . . . . 0.0 110.929 170.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -62.0 -47.83 83.02 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.7 0.682 . . . . 0.0 110.807 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 54.7 mt -66.04 -28.99 69.27 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.551 -0.718 . . . . 0.0 112.025 -175.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.1 m -74.73 -38.53 62.25 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.795 0.838 . . . . 0.0 111.373 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -79.39 -31.16 42.73 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 117.53 -1.224 . . . . 0.0 113.555 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.5 mp -51.23 -42.16 79.47 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 120.79 1.632 . . . . 0.0 113.305 178.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -71.76 -38.37 4.3 Favored 'Trans proline' 0 C--N 1.352 0.763 0 CA-C-N 122.138 1.799 . . . . 0.0 113.574 169.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mmtt -67.19 -33.41 75.33 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.084 -1.635 . . . . 0.0 113.801 -176.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.3 m -68.2 -18.5 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.1 mt -87.68 -50.44 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.632 1.173 . . . . 0.0 110.268 172.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -58.56 -36.83 74.55 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.091 0.957 . . . . 0.0 111.934 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -70.85 -28.72 64.8 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.604 0.638 . . . . 0.0 111.882 177.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -77.11 -41.52 41.73 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.982 -1.073 . . . . 0.0 112.658 176.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.81 -29.2 67.5 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 120.71 1.595 . . . . 0.0 113.973 177.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.416 ' HG3' HD22 ' A' ' 61' ' ' ASN . 14.0 ptpt -81.48 -27.5 34.54 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 115.387 1.625 . . . . 0.0 115.387 173.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.416 HD22 ' HG3' ' A' ' 60' ' ' LYS . 17.8 m-80 -130.8 70.84 82.58 Favored Pre-proline 0 CA--C 1.554 1.127 0 C-N-CA 125.625 1.57 . . . . 0.0 110.754 173.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.92 -11.99 13.85 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 124.858 3.705 . . . . 0.0 116.368 -177.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -84.63 -21.45 30.28 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.359 1.464 . . . . 0.0 113.292 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -67.9 156.34 37.41 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.669 0.787 . . . . 0.0 111.996 -173.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -89.06 131.72 35.09 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 172.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.5 tp -49.4 -38.42 28.85 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -169.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.463 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.26 5.4 m-85 -78.46 -8.3 58.37 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.369 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.7 p -61.01 -23.54 65.48 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.416 -1.427 . . . . 0.0 111.633 167.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.82 -10.72 59.95 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.699 -1.25 . . . . 0.0 112.568 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -31.78 71.44 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.725 1.148 . . . . 0.0 111.185 168.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.42 -13.44 62.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.642 1.177 . . . . 0.0 112.312 -173.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -82.87 -29.85 29.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 127.398 2.279 . . . . 0.0 114.689 173.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -107.97 122.92 47.83 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -164.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 27.6 p -85.78 -41.84 14.72 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.692 0.997 . . . . 0.0 113.692 170.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 56.77 -172.07 0.08 Allowed 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 126.395 1.878 . . . . 0.0 113.175 -170.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -81.37 -27.19 34.97 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 -166.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.544 ' H ' HD23 ' A' ' 77' ' ' LEU . 2.1 pt? -60.55 147.88 82.28 Favored Pre-proline 0 CA--C 1.546 0.813 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -178.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -77.41 162.21 31.0 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 123.011 2.474 . . . . 0.0 110.508 167.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.0 t30 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 124.843 1.257 . . . . 0.0 112.297 177.794 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.902 0 CA-C-O 121.011 0.434 . . . . 0.0 112.05 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 54.1 t30 59.4 44.16 15.49 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 125.879 1.672 . . . . 0.0 115.044 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -64.41 -22.37 66.94 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.348 0.659 . . . . 0.0 111.618 167.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 9.2 t 94.44 104.52 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 129.407 3.083 . . . . 0.0 116.231 168.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.16 -33.64 74.89 Favored 'General case' 0 CA--C 1.551 0.996 0 O-C-N 120.711 -1.243 . . . . 0.0 111.191 169.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.465 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 23.4 mtmt -62.61 -28.03 69.61 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.416 1.486 . . . . 0.0 114.178 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -105.91 8.23 32.5 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.634 1.173 . . . . 0.0 113.478 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 49.2 ttm -63.91 130.34 43.69 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.644 -1.285 . . . . 0.0 110.392 173.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.2 t -79.32 156.28 28.1 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 121.01 -1.056 . . . . 0.0 110.814 173.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -60.25 -32.67 71.37 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 120.079 -1.638 . . . . 0.0 112.884 -178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -63.3 -32.13 73.46 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 172.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -74.96 -40.4 60.78 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.646 0.779 . . . . 0.0 111.938 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -60.34 -46.02 91.41 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 118.221 0.464 . . . . 0.0 111.892 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -72.21 -10.44 13.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.614 175.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -93.45 -20.25 20.48 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 170.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.99 156.0 37.15 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.029 0.932 . . . . 0.0 112.285 -179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.436 HD21 ' HD2' ' B' ' 98' ' ' LYS . 1.1 t-20 -56.11 135.45 74.44 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 124.631 1.172 . . . . 0.0 113.203 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 13.6 Cg_exo -75.39 -5.87 17.12 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.419 1.413 . . . . 0.0 115.474 -178.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.45 ' HB2' ' HE2' ' A' ' 8' ' ' MET . 12.8 mttt -70.68 -59.74 2.65 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.48 1.491 . . . . 0.0 109.509 167.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . 0.437 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -81.55 -11.38 59.18 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -177.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 23.8 ttm -53.98 -31.09 49.66 Favored 'General case' 0 N--CA 1.481 1.118 0 O-C-N 120.611 -1.306 . . . . 0.0 112.92 171.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 36.3 m -68.44 -57.36 8.73 Favored Pre-proline 0 N--CA 1.484 1.254 0 CA-C-O 117.998 -1.001 . . . . 0.0 112.751 -179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.03 -36.27 75.43 Favored 'Trans proline' 0 N--CA 1.484 0.926 0 C-N-CA 123.83 3.02 . . . . 0.0 114.096 169.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.496 HG21 ' HB1' ' A' ' 20' ' ' ALA . 60.7 t -64.12 -52.17 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 O-C-N 121.469 -0.769 . . . . 0.0 111.395 175.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.42 -36.36 80.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.636 1.175 . . . . 0.0 111.372 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.513 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 78.7 t90 -71.31 -51.12 26.12 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-O 117.054 -1.45 . . . . 0.0 113.088 171.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.447 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 2.0 t90 -66.91 -27.68 67.69 Favored 'General case' 0 C--N 1.349 0.582 0 C-N-CA 116.911 -1.916 . . . . 0.0 111.139 -169.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.6 tmm? -60.59 -42.1 96.05 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.082 0.953 . . . . 0.0 112.217 169.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.1 -24.4 63.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.046 1.338 . . . . 0.0 114.395 177.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -109.28 -20.2 13.03 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 62.16 158.28 0.06 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.641 2.776 . . . . 0.0 116.881 -172.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -75.56 -3.27 33.26 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.931 1.692 . . . . 0.0 112.639 171.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 58.6 p -66.6 154.88 39.34 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.011 1.324 . . . . 0.0 112.083 175.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.6 p -88.33 147.01 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.515 0.726 . . . . 0.0 112.681 -169.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -75.8 159.76 30.69 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.429 1.091 . . . . 0.0 112.824 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 10.2 ptpt -140.02 23.75 2.39 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 116.884 2.179 . . . . 0.0 116.884 -168.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 172.48 -55.48 0.17 Allowed Glycine 0 CA--C 1.534 1.224 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 170.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -81.37 178.38 53.89 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 123.722 0.677 . . . . 0.0 114.711 -174.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 29.0 m-20 -65.21 139.03 58.61 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.92 0.888 . . . . 0.0 109.226 169.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.05 153.06 23.16 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -166.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . 0.306 33.0 m 52.88 19.67 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 128.719 2.808 . . . . 0.0 117.384 171.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.42 -30.99 69.97 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . 0.411 0.3 OUTLIER 61.18 161.2 0.06 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.697 2.399 . . . . 0.0 114.658 -167.059 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -130.13 169.28 15.54 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.854 1.662 . . . . 0.0 111.857 -167.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -63.2 -26.23 68.7 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.704 -1.247 . . . . 0.0 112.238 171.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 91.1 m -60.77 -43.53 97.92 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.878 0.871 . . . . 0.0 110.72 169.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -65.18 -48.57 73.0 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.748 -0.595 . . . . 0.0 110.25 175.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 94.5 mt -56.47 -29.96 62.35 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 176.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 42.5 m -81.07 -36.39 30.53 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.092 0.957 . . . . 0.0 112.187 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.4 mm100 -80.24 -30.06 38.48 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 121.055 -1.028 . . . . 0.0 113.723 -177.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.84 -41.4 84.53 Favored Pre-proline 0 CA--C 1.552 1.052 0 CA-C-N 120.351 1.432 . . . . 0.0 113.629 178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -73.29 -37.32 3.39 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 CA-C-N 122.477 1.92 . . . . 0.0 113.468 169.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -67.65 -28.84 68.05 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 120.338 -1.477 . . . . 0.0 114.232 -175.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.25 -26.72 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 118.59 0.632 . . . . 0.0 112.076 173.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 43.6 mt -70.24 -51.27 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 123.927 0.891 . . . . 0.0 109.438 171.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -53.21 -48.85 67.8 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.79 0.836 . . . . 0.0 112.033 173.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -70.09 -25.1 63.36 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.124 -0.985 . . . . 0.0 112.075 -174.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.34 -46.2 28.65 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.635 0.774 . . . . 0.0 112.177 175.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -26.69 67.36 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 120.389 1.45 . . . . 0.0 113.622 173.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 15.6 mttm -70.28 -31.58 69.0 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 168.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 25.8 m-80 -133.18 65.25 72.77 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 125.046 1.338 . . . . 0.0 112.381 -179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -58.82 -15.29 25.93 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 123.094 2.529 . . . . 0.0 116.732 -171.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -83.7 -16.42 45.0 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.922 1.289 . . . . 0.0 113.603 -177.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.1 mmpt? -72.87 153.8 40.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.953 0.901 . . . . 0.0 111.375 -172.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 46.4 t30 -85.62 132.82 34.1 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.5 tp -51.52 -36.16 43.68 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -168.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.465 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 6.1 m-85 -81.76 -6.47 59.08 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 66.3 p -61.19 -27.55 68.5 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 120.524 -1.36 . . . . 0.0 111.317 168.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.7 m-30 -71.37 -4.02 23.95 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.472 1.509 . . . . 0.0 114.317 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.43 -29.46 37.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.97 1.308 . . . . 0.0 112.021 167.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 84.5 m-20 -73.26 -32.31 64.62 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.646 1.178 . . . . 0.0 112.2 -171.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.36 -28.6 67.26 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.697 1.599 . . . . 0.0 114.864 173.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -82.04 -36.08 28.11 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 115.987 1.847 . . . . 0.0 115.987 -166.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.7 m 44.97 53.23 7.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.845 1.258 . . . . 0.0 112.466 -170.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.26 165.98 6.79 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 124.973 1.309 . . . . 0.0 112.651 -172.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -62.47 127.63 32.23 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -172.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -157.02 161.9 28.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 126.928 2.091 . . . . 0.0 111.374 173.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -59.98 151.49 71.54 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.354 2.702 . . . . 0.0 114.042 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 32.6 m120 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 124.991 1.316 . . . . 0.0 112.704 177.013 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 121.625 0.726 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.333 0.2 OUTLIER 68.45 33.91 3.89 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.212 1.805 . . . . 0.0 115.289 173.271 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -73.04 163.47 28.11 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 126.041 1.736 . . . . 0.0 106.438 162.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.8 t -102.57 103.44 13.77 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 125.367 1.467 . . . . 0.0 113.091 -164.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.07 -31.99 70.52 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.434 -1.416 . . . . 0.0 110.748 171.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.471 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.0 ptpt -74.1 -4.69 37.14 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 176.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -125.83 12.29 7.87 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.151 1.381 . . . . 0.0 112.139 168.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.0 ttm -60.6 122.44 14.72 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.623 -1.298 . . . . 0.0 108.544 170.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.9 t -75.96 154.64 35.72 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.867 -1.146 . . . . 0.0 110.421 178.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.66 -30.94 71.97 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.267 -1.521 . . . . 0.0 113.342 -172.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -40.72 97.52 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.017 0.826 . . . . 0.0 111.928 170.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -67.69 -37.36 82.2 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.199 1.0 . . . . 0.0 111.568 176.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.65 -51.86 67.62 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.563 0.745 . . . . 0.0 112.353 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -69.43 -1.77 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 124.554 1.142 . . . . 0.0 112.737 176.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -106.59 -7.58 17.36 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.483 1.513 . . . . 0.0 113.587 171.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.14 160.71 29.48 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.021 -1.049 . . . . 0.0 111.135 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.444 HD21 ' HD3' ' A' ' 19' ' ' LYS . 46.2 t-20 -66.0 128.76 94.04 Favored Pre-proline 0 N--CA 1.484 1.273 0 O-C-N 121.024 -1.047 . . . . 0.0 111.528 -175.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.6 -21.02 23.11 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 124.094 3.196 . . . . 0.0 115.607 178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.8 mptt -57.89 -68.07 0.28 Allowed 'General case' 0 C--N 1.351 0.639 0 C-N-CA 126.117 1.767 . . . . 0.0 109.539 168.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.423 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -78.17 -7.9 57.64 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 10.9 ttt -62.84 -35.86 81.33 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 120.291 -1.505 . . . . 0.0 113.206 170.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.4 m -60.43 -53.66 62.53 Favored Pre-proline 0 N--CA 1.485 1.311 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 178.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.409 ' HA ' ' CE2' ' B' ' 106' ' ' TRP . 2.7 Cg_endo -49.31 -47.12 23.38 Favored 'Trans proline' 0 CA--C 1.51 -0.694 0 C-N-CA 123.389 2.726 . . . . 0.0 114.133 167.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 20' ' ' ALA . 57.2 t -57.88 -32.94 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.807 0.443 . . . . 0.0 111.793 -178.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.96 -27.42 65.71 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.385 1.074 . . . . 0.0 113.579 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.415 ' CB ' ' CH2' ' B' ' 106' ' ' TRP . 52.4 t90 -88.14 -39.38 14.58 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 119.81 1.186 . . . . 0.0 109.993 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.537 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 3.6 m95 -62.76 -35.08 78.67 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -167.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -72.85 -47.61 44.65 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.257 1.423 . . . . 0.0 112.787 168.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -73.99 -28.71 61.6 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.829 1.251 . . . . 0.0 114.12 -168.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -116.6 -5.76 11.65 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.015 1.326 . . . . 0.0 114.365 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 61.99 168.48 0.11 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 127.444 2.298 . . . . 0.0 116.69 175.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.94 0.03 12.34 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 125.972 1.709 . . . . 0.0 114.422 174.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.8 t -75.95 -179.34 4.82 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.54 1.936 . . . . 0.0 113.978 -176.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.8 p -110.78 146.31 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 125.445 1.498 . . . . 0.0 112.297 178.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -71.18 161.7 30.66 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.888 1.275 . . . . 0.0 113.479 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.2 mmpt? -78.62 -18.77 54.0 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -169.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -171.62 -22.27 0.02 OUTLIER Glycine 0 CA--C 1.534 1.261 0 N-CA-C 116.263 1.265 . . . . 0.0 116.263 173.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.38 -172.89 33.82 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-N 118.934 1.367 . . . . 0.0 114.586 178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -132.41 11.77 4.52 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.79 1.636 . . . . 0.0 114.17 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.6 m -76.95 72.17 3.5 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.882 1.273 . . . . 0.0 112.159 -170.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 26.7 m -64.23 -11.46 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 124.789 1.235 . . . . 0.0 114.033 177.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.99 145.43 10.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.711 2.004 . . . . 0.0 113.154 175.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 38.2 mt -69.96 117.08 11.08 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.232 0.613 . . . . 0.0 109.703 172.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -80.44 170.85 15.82 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.841 1.256 . . . . 0.0 109.761 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -65.53 -24.93 67.24 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.855 -1.778 . . . . 0.0 112.531 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.7 m -65.84 -46.32 78.97 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.414 -0.804 . . . . 0.0 110.833 168.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -58.61 -48.47 80.86 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.898 0.772 . . . . 0.0 110.245 174.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.49 -25.15 68.13 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.141 -0.975 . . . . 0.0 112.439 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.0 m -78.54 -37.98 41.56 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.592 0.757 . . . . 0.0 111.467 171.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 mm100 -81.7 -30.85 32.41 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 117.974 -1.012 . . . . 0.0 113.148 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -51.04 -41.68 75.56 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-O 117.232 -1.366 . . . . 0.0 113.008 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.95 -37.85 2.59 Favored 'Trans proline' 0 C--N 1.352 0.752 0 CA-C-N 122.336 1.87 . . . . 0.0 113.807 168.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.4 mmtt -67.82 -33.41 74.74 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.032 -1.667 . . . . 0.0 113.633 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 19.1 m -68.32 -13.95 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 173.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.4 mt -92.09 -51.09 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.635 1.174 . . . . 0.0 110.578 171.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -58.89 -35.52 73.15 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.974 0.909 . . . . 0.0 111.771 179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -68.53 -29.62 68.24 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 122.078 -0.389 . . . . 0.0 111.915 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 3.8 m -76.27 -45.7 31.44 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 120.838 -1.164 . . . . 0.0 112.745 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.54 68.79 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.644 1.566 . . . . 0.0 113.977 177.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -77.06 -32.82 57.14 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -133.2 77.22 67.4 Favored Pre-proline 0 CA--C 1.551 1.007 0 C-N-CA 124.639 1.176 . . . . 0.0 112.094 171.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.55 -9.96 3.13 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 124.772 3.648 . . . . 0.0 117.024 175.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.39 -25.57 51.0 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.045 1.338 . . . . 0.0 112.511 -177.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -67.13 153.59 43.3 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.926 1.291 . . . . 0.0 111.448 -172.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -87.38 131.61 34.23 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 169.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.5 tp -51.72 -36.72 47.99 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -169.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.471 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.0 m-85 -79.57 -6.85 57.9 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 -178.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 58.8 p -59.79 -26.7 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.458 -1.401 . . . . 0.0 111.053 167.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -71.84 -3.1 20.35 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.754 1.622 . . . . 0.0 114.143 177.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -31.65 25.5 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.976 1.31 . . . . 0.0 111.693 169.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.3 -26.19 64.61 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.27 1.028 . . . . 0.0 112.151 -171.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -74.85 -29.51 61.07 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.563 1.545 . . . . 0.0 114.929 171.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.85 111.72 24.02 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.04 1.336 . . . . 0.0 114.604 -166.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 34.8 p -74.65 -31.01 61.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.148 0.979 . . . . 0.0 112.433 168.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 47.9 t30 50.19 -143.27 0.59 Allowed 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 126.76 2.024 . . . . 0.0 113.285 -179.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -139.93 119.96 13.63 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.309 1.443 . . . . 0.0 111.133 173.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.2 mp -105.55 120.67 48.62 Favored Pre-proline 0 CA--C 1.546 0.815 0 C-N-CA 124.339 1.056 . . . . 0.0 110.188 -178.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_exo -57.57 123.64 14.23 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.584 2.856 . . . . 0.0 113.567 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.4 p30 . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.229 1.812 . . . . 0.0 112.531 -172.846 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.0 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.282 10.7 t-20 63.5 35.21 12.09 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.109 1.433 . . . . 0.0 114.313 177.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -73.04 159.13 34.1 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.142 1.777 . . . . 0.0 106.8 164.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 15.6 t -93.94 97.56 10.44 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -166.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.74 -33.25 64.11 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 120.944 -1.098 . . . . 0.0 111.091 170.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -64.41 -31.33 72.49 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.537 1.935 . . . . 0.0 114.608 177.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -114.26 13.9 17.98 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.925 1.29 . . . . 0.0 113.132 -177.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 59.0 ttm -58.77 122.31 13.25 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.919 -1.113 . . . . 0.0 108.888 169.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.6 t -77.46 156.84 30.81 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 120.876 -1.14 . . . . 0.0 110.682 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.04 -34.06 76.76 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.142 -1.598 . . . . 0.0 112.909 -173.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -65.1 -31.45 72.66 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.192 0.906 . . . . 0.0 112.595 173.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -77.63 -37.08 50.87 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.784 1.234 . . . . 0.0 111.35 174.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -62.51 -49.42 75.44 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.331 -0.856 . . . . 0.0 112.28 176.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.05 -7.61 8.27 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.683 0.793 . . . . 0.0 112.971 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -100.88 -13.91 18.16 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.936 1.694 . . . . 0.0 113.877 171.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.34 158.42 35.11 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 119.454 1.025 . . . . 0.0 111.114 173.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -62.33 133.91 94.62 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.894 0.878 . . . . 0.0 112.815 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.43 -13.88 33.43 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.789 2.326 . . . . 0.0 116.042 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.3 mptt -66.38 -50.41 63.58 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 121.151 1.796 . . . . 0.0 107.929 168.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -87.98 -5.18 58.66 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 25.0 mtt -55.46 -44.48 76.44 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.652 -1.28 . . . . 0.0 111.98 169.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 89.4 m -61.17 -52.62 70.16 Favored Pre-proline 0 N--CA 1.479 0.989 0 C-N-CA 124.666 1.186 . . . . 0.0 113.088 -175.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.428 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 11.6 Cg_endo -52.97 -49.75 16.48 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 124.047 3.165 . . . . 0.0 114.983 171.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 13.1 p -67.06 -37.05 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 O-C-N 120.672 -1.268 . . . . 0.0 112.867 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.38 -29.8 70.74 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 117.955 -1.022 . . . . 0.0 111.593 175.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.537 ' CD2' ' CZ2' ' A' ' 27' ' ' TRP . 73.2 t90 -81.81 -46.42 14.2 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 120.191 1.359 . . . . 0.0 112.452 173.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.415 ' CH2' ' CB ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -41.02 -38.55 1.01 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.703 0.801 . . . . 0.0 111.962 169.485 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 57.5 ttp -75.08 -64.58 1.02 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.409 1.484 . . . . 0.0 113.849 169.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.39 -31.06 65.42 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -170.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -125.64 21.66 7.7 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -171.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 58.53 93.75 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 116.759 2.133 . . . . 0.0 116.759 169.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 13.7 tm-20 -57.78 -27.71 63.34 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.299 -0.876 . . . . 0.0 111.686 166.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 18.7 p -71.41 39.18 0.06 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 128.878 2.871 . . . . 0.0 114.841 -177.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . 0.287 0.5 OUTLIER 71.31 152.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 128.184 2.594 . . . . 0.0 115.634 178.357 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -101.63 176.8 5.1 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.623 1.569 . . . . 0.0 113.373 -170.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 4.4 ptpt -147.91 163.77 35.79 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.685 1.594 . . . . 0.0 112.001 -174.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.41 -105.06 1.33 Allowed Glycine 0 CA--C 1.537 1.442 0 C-N-CA 123.763 0.696 . . . . 0.0 113.126 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -165.89 150.78 18.67 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.042 0.829 . . . . 0.0 113.861 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . 0.309 4.7 p-10 38.28 -127.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 126.772 2.029 . . . . 0.0 114.269 -175.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . 0.25 41.5 p 47.8 -0.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 177.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 28.5 m -63.53 -2.74 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 C-N-CA 127.006 2.123 . . . . 0.0 114.501 172.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.8 159.65 5.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.394 1.478 . . . . 0.0 112.1 169.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 66.0 tp -76.97 120.95 22.8 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 165.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 15.3 m-80 -103.53 164.62 11.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.306 1.042 . . . . 0.0 112.536 -169.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -66.51 -26.67 67.27 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.286 -1.509 . . . . 0.0 112.586 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.6 m -62.99 -45.4 92.58 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.507 -0.746 . . . . 0.0 110.919 169.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.32 -55.57 33.06 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.712 0.687 . . . . 0.0 109.473 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 96.2 mt -54.57 -33.67 60.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.145 0.978 . . . . 0.0 112.881 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 51.9 m -77.51 -35.2 53.74 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.664 0.786 . . . . 0.0 111.92 175.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -81.22 -23.46 38.09 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.5 mm -52.94 -47.05 96.87 Favored Pre-proline 0 N--CA 1.482 1.126 0 CA-C-N 120.305 1.411 . . . . 0.0 112.338 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.3 -34.95 14.98 Favored 'Trans proline' 0 C--N 1.354 0.855 0 CA-C-N 122.065 1.773 . . . . 0.0 113.612 172.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.2 mmtt -66.0 -32.06 73.33 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 120.625 -1.297 . . . . 0.0 113.539 -176.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.91 -28.31 29.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 61.5 mt -69.55 -49.53 58.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.883 0.873 . . . . 0.0 109.8 172.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -56.39 -53.52 56.41 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.712 0.805 . . . . 0.0 111.208 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -62.56 -26.41 68.56 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.073 -1.017 . . . . 0.0 113.068 -177.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -77.75 -48.01 17.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.187 0.903 . . . . 0.0 112.561 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.84 -25.2 67.1 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 121.059 1.754 . . . . 0.0 113.653 175.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -73.45 -28.02 61.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.725 1.61 . . . . 0.0 114.478 168.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -135.01 63.65 58.51 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.122 1.369 . . . . 0.0 110.735 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -63.82 -12.42 31.6 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 123.403 2.735 . . . . 0.0 115.871 -168.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.16 -17.01 38.5 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.348 1.459 . . . . 0.0 113.447 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -74.32 161.38 29.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.536 1.135 . . . . 0.0 111.985 -173.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -75.02 159.99 31.08 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.68 -0.638 . . . . 0.0 109.772 169.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.9 tp -70.8 -62.91 1.22 Allowed 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.586 -0.696 . . . . 0.0 112.257 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -61.52 -24.0 66.31 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 -167.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.7 t -57.46 -23.68 51.25 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.742 -0.599 . . . . 0.0 112.066 172.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -63.85 -3.46 2.46 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 119.789 -1.819 . . . . 0.0 114.5 174.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -35.38 63.28 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.235 1.379 . . . . 0.0 111.396 165.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.65 -33.56 75.89 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -167.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -67.53 -27.22 66.79 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.541 1.937 . . . . 0.0 115.053 172.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -101.43 106.27 17.38 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.102 1.361 . . . . 0.0 113.845 -167.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 50.8 m -77.59 73.12 4.16 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.241 1.016 . . . . 0.0 110.258 169.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -69.54 172.54 7.16 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.698 1.199 . . . . 0.0 112.591 -174.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -77.13 49.64 0.69 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.009 1.723 . . . . 0.0 114.259 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -112.12 152.64 44.52 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 127.546 2.338 . . . . 0.0 111.208 172.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.64 161.29 37.09 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.055 2.503 . . . . 0.0 112.852 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.342 0 C-N-CA 125.659 1.584 . . . . 0.0 111.092 178.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.09 0 CA-C-O 121.226 0.536 . . . . 0.0 112.327 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.264 45.8 t30 60.34 42.6 14.64 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.101 1.76 . . . . 0.0 115.041 175.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.404 ' C ' ' HG3' ' B' ' 98' ' ' LYS . 23.3 mm-40 -59.31 -26.12 64.73 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 123.724 0.81 . . . . 0.0 111.475 166.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.8 t 97.78 106.52 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 129.647 3.179 . . . . 0.0 114.682 168.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.49 -31.0 70.97 Favored 'General case' 0 CA--C 1.552 1.023 0 O-C-N 120.708 -1.245 . . . . 0.0 111.347 170.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.449 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 9.1 mtmt -63.65 -25.08 68.05 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 125.449 1.5 . . . . 0.0 114.366 175.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -107.09 5.85 28.33 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.829 1.252 . . . . 0.0 113.356 175.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 41.4 ttm -62.03 125.31 23.43 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.656 -1.277 . . . . 0.0 109.922 173.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -78.57 155.92 29.42 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.842 -1.161 . . . . 0.0 110.187 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.63 -35.71 78.66 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 120.588 -1.32 . . . . 0.0 112.84 -174.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -61.69 -35.03 76.83 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 172.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -77.09 -37.38 54.51 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.653 1.181 . . . . 0.0 111.342 176.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -60.49 -49.91 75.65 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.619 -0.675 . . . . 0.0 112.378 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.5 pt -69.49 -1.68 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 124.394 1.078 . . . . 0.0 112.663 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -110.0 -12.27 14.55 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 125.522 1.529 . . . . 0.0 113.897 174.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.25 163.08 25.81 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 121.02 -1.05 . . . . 0.0 110.5 169.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.481 HD21 ' HD3' ' A' ' 19' ' ' LYS . 47.4 t-20 -66.1 131.18 94.42 Favored Pre-proline 0 N--CA 1.483 1.192 0 O-C-N 120.745 -1.222 . . . . 0.0 112.05 -178.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 30.6 Cg_exo -61.39 -16.3 46.37 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.459 2.772 . . . . 0.0 115.415 179.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HD3' HD21 ' A' ' 17' ' ' ASN . 5.1 mptt -56.93 -61.74 2.23 Favored 'General case' 0 C--N 1.35 0.61 0 C-N-CA 125.983 1.713 . . . . 0.0 108.814 168.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.452 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -82.44 -7.74 59.63 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 86.5 mtp -58.86 -37.0 75.52 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 120.403 1.456 . . . . 0.0 112.859 171.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 32.9 m -62.04 -55.96 36.06 Favored Pre-proline 0 N--CA 1.486 1.344 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -56.21 -39.05 93.72 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.265 2.643 . . . . 0.0 112.885 169.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 20' ' ' ALA . 99.1 t -60.39 -42.84 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 120.033 -1.667 . . . . 0.0 111.969 175.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.34 -41.98 79.97 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.082 0.953 . . . . 0.0 110.962 -176.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HB3' ' CH2' ' B' ' 106' ' ' TRP 0.267 0.0 OUTLIER -73.34 -41.58 63.3 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 115.974 -1.965 . . . . 0.0 111.404 177.029 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.484 ' CZ2' ' CG ' ' B' ' 105' ' ' TRP . 0.3 OUTLIER -65.58 -25.22 67.31 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 122.644 2.474 . . . . 0.0 113.85 175.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -67.04 -45.52 77.17 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.808 -0.557 . . . . 0.0 111.144 168.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.52 -35.14 73.02 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.136 1.374 . . . . 0.0 113.734 -177.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.7 m-70 -133.68 102.51 5.5 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.446 2.298 . . . . 0.0 108.049 172.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.438 ' C ' ' H ' ' A' ' 33' ' ' THR . 49.0 mt-10 -67.24 -178.67 0.86 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.916 1.287 . . . . 0.0 113.375 -174.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 pm0 -66.51 18.11 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 125.364 1.465 . . . . 0.0 113.073 167.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.438 ' H ' ' C ' ' A' ' 31' ' ' GLU . 13.1 t -74.48 156.45 36.91 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.399 2.28 . . . . 0.0 112.462 173.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 84.0 t -81.0 133.44 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.394 1.078 . . . . 0.0 109.862 176.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -66.04 22.97 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 129.198 2.999 . . . . 0.0 118.126 -169.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt 60.83 15.28 5.82 Favored 'General case' 0 N--CA 1.492 1.652 0 C-N-CA 126.196 1.798 . . . . 0.0 115.605 171.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.95 1.87 72.49 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 125.388 1.47 . . . . 0.0 115.085 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.17 179.41 48.0 Favored Glycine 0 CA--C 1.539 1.592 0 CA-C-N 118.636 1.218 . . . . 0.0 112.813 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -75.84 119.75 20.25 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.657 -0.908 . . . . 0.0 110.617 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.4 m -68.11 138.66 55.91 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.942 0.897 . . . . 0.0 112.447 -169.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . 0.3 11.0 m 56.26 4.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 128.969 2.908 . . . . 0.0 118.025 -176.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.01 154.41 41.25 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 120.227 1.376 . . . . 0.0 112.79 171.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -147.73 169.29 20.03 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.201 1.4 . . . . 0.0 112.475 -179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -133.04 174.63 10.15 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.868 2.067 . . . . 0.0 110.889 -169.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -63.15 -24.58 67.96 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.805 -1.185 . . . . 0.0 112.433 171.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 54.3 m -58.64 -47.47 84.3 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 121.503 -0.748 . . . . 0.0 110.985 168.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -61.86 -44.11 97.49 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 121.414 -0.804 . . . . 0.0 110.062 179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 68.3 mt -64.57 -19.24 65.53 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.143 0.977 . . . . 0.0 112.954 175.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.5 m -89.15 -27.63 20.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.529 1.932 . . . . 0.0 112.323 173.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -83.45 -33.98 25.54 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 120.814 -1.178 . . . . 0.0 111.823 176.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.52 -42.76 89.76 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-O 117.227 -1.368 . . . . 0.0 113.535 175.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -69.13 -39.77 7.25 Favored 'Trans proline' 0 C--N 1.35 0.654 0 CA-C-N 122.571 1.954 . . . . 0.0 112.845 169.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -62.94 -38.81 92.53 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 120.625 1.557 . . . . 0.0 113.461 -176.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 26.0 m -70.41 -19.54 22.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 123.372 0.669 . . . . 0.0 112.491 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.8 mt -81.36 -47.99 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.316 -0.865 . . . . 0.0 109.933 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.84 -37.22 78.64 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.101 0.96 . . . . 0.0 112.008 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -68.62 -26.23 65.25 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.695 0.679 . . . . 0.0 111.758 177.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.0 m -77.65 -46.74 21.11 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 121.234 -0.916 . . . . 0.0 112.89 174.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.21 -29.17 67.95 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 120.799 1.636 . . . . 0.0 114.166 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -76.66 -27.76 55.72 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -135.16 74.31 62.59 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 124.996 1.318 . . . . 0.0 112.073 172.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -59.03 -9.66 8.39 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 124.36 3.373 . . . . 0.0 117.371 -177.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -82.21 -22.11 36.08 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.981 1.312 . . . . 0.0 113.139 -178.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.6 mmpt? -68.9 157.7 36.06 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.3 1.04 . . . . 0.0 111.7 -174.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -75.86 152.39 37.21 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 169.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.6 tp -68.5 -39.92 81.1 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.015 -1.053 . . . . 0.0 113.087 178.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.449 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 4.2 m-85 -86.68 -19.28 29.46 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.0 t -58.97 -23.46 61.7 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.318 -0.864 . . . . 0.0 111.671 170.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -58.19 -15.81 11.27 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 119.761 -1.837 . . . . 0.0 112.902 171.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.3 tptt -58.58 -35.28 72.15 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.045 -1.034 . . . . 0.0 112.597 168.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.16 -26.03 67.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.714 0.806 . . . . 0.0 112.208 -169.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -68.48 -30.21 69.0 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.894 2.078 . . . . 0.0 114.233 174.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -112.78 106.96 15.42 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 -165.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 33.0 p -107.49 2.18 24.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.61 1.564 . . . . 0.0 114.894 176.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -63.04 159.37 17.32 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.099 1.148 . . . . 0.0 114.099 -169.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.5 t70 67.27 -40.69 0.4 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 128.678 2.791 . . . . 0.0 116.177 178.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 77.4 mt -68.21 128.46 93.2 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 124.678 1.191 . . . . 0.0 111.35 -177.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.85 167.2 27.61 Favored 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.063 2.509 . . . . 0.0 112.532 177.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.255 1.354 0 C-N-CA 125.932 1.693 . . . . 0.0 113.213 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.303 0.3 OUTLIER 66.97 36.03 4.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.303 1.441 . . . . 0.0 114.622 172.774 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -75.06 160.54 30.37 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.215 1.806 . . . . 0.0 106.201 163.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.2 t -97.84 98.36 9.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 120.948 -1.095 . . . . 0.0 113.89 -166.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.52 62.79 Favored 'General case' 0 CA--C 1.555 1.164 0 O-C-N 120.771 -1.205 . . . . 0.0 110.815 169.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.0 mtmt -59.7 -30.78 69.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 126.988 2.115 . . . . 0.0 115.03 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -117.52 12.69 14.2 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.837 1.255 . . . . 0.0 113.107 -175.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 54.4 ttm -60.88 119.7 8.74 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.002 -1.061 . . . . 0.0 108.949 169.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.4 t -75.95 156.42 34.19 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.115 -0.99 . . . . 0.0 110.422 -179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -33.19 73.86 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 120.486 -1.384 . . . . 0.0 112.957 -172.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -65.75 -32.87 74.66 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.153 0.888 . . . . 0.0 112.865 173.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 62.5 tt0 -77.41 -35.6 54.04 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.274 1.43 . . . . 0.0 111.17 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -63.51 -51.36 65.83 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.307 1.043 . . . . 0.0 112.411 175.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.9 pt -68.01 -4.03 2.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.892 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 176.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -103.01 -11.25 18.3 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.088 1.755 . . . . 0.0 114.182 170.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.17 157.61 37.31 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.983 1.265 . . . . 0.0 110.748 171.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.413 HD21 ' HD3' ' B' ' 98' ' ' LYS 0.262 0.1 OUTLIER -73.37 146.51 86.61 Favored Pre-proline 0 CA--C 1.549 0.933 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -169.66 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -71.84 -10.55 26.51 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 121.865 1.71 . . . . 0.0 114.717 -177.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.413 ' HD3' HD21 ' B' ' 96' ' ' ASN . 5.8 mptt -67.81 -55.44 12.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.876 1.216 . . . . 0.0 108.572 167.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -83.65 -13.96 52.98 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 115.733 1.753 . . . . 0.0 115.733 -174.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 3.9 mmt -47.69 -43.43 26.55 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.742 1.156 . . . . 0.0 112.581 171.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -61.3 -55.31 44.77 Favored Pre-proline 0 N--CA 1.481 1.111 0 C-N-CA 124.535 1.134 . . . . 0.0 113.606 -171.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.402 ' HA ' ' CE3' ' A' ' 27' ' ' TRP . 14.0 Cg_endo -54.7 -47.4 26.92 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 123.471 2.781 . . . . 0.0 114.513 171.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 14.7 p -70.17 -34.54 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 O-C-N 120.574 -1.329 . . . . 0.0 113.095 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.61 -25.21 67.28 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.671 0.788 . . . . 0.0 111.746 173.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.484 ' CG ' ' CZ2' ' A' ' 27' ' ' TRP . 62.6 t90 -80.78 -50.27 10.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.436 1.017 . . . . 0.0 111.254 168.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.435 ' CH2' ' HB3' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -50.45 -44.37 55.47 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 121.696 0.76 . . . . 0.0 112.258 -172.724 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -64.47 -45.36 87.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.317 1.047 . . . . 0.0 112.045 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.83 -29.67 58.71 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.072 1.349 . . . . 0.0 113.012 -171.11 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . 0.555 ' CG ' HD22 ' B' ' 154' ' ' ASN . 1.6 t60 -126.75 -17.66 4.93 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 116.398 1.999 . . . . 0.0 116.398 -173.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 65.39 156.4 0.09 Allowed 'General case' 0 CA--C 1.553 1.058 0 N-CA-C 116.93 2.196 . . . . 0.0 116.93 174.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -88.89 5.55 43.38 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.571 1.548 . . . . 0.0 113.836 175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 15.8 p -63.12 137.58 58.28 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.403 -0.811 . . . . 0.0 110.389 169.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 4.4 p -64.89 139.35 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -168.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -76.7 160.02 29.69 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.131 0.972 . . . . 0.0 111.701 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.27 62.82 0.61 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.582 1.553 . . . . 0.0 112.063 -178.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 87.38 6.2 78.19 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 125.581 1.562 . . . . 0.0 115.52 -177.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -88.64 162.9 32.0 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.603 1.097 . . . . 0.0 114.019 178.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -135.09 19.78 3.44 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.605 1.562 . . . . 0.0 113.499 -177.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 47.5 p -71.09 7.1 1.32 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 116.255 1.946 . . . . 0.0 116.255 -168.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 9.1 m -58.82 -15.31 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 125.596 1.558 . . . . 0.0 112.636 167.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 11.9 p -50.0 -25.62 3.52 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 126.943 2.097 . . . . 0.0 114.618 168.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 53.2 mt 68.07 79.51 0.22 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 127.665 2.386 . . . . 0.0 111.219 -169.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -60.57 165.68 3.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 112.997 -1.91 . . . . 0.0 111.912 169.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.87 -23.51 65.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -172.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.2 m -68.05 -47.76 67.48 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.117 0.871 . . . . 0.0 110.618 171.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.91 -49.77 76.55 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.454 1.025 . . . . 0.0 111.65 172.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.6 mt -57.67 -32.64 67.51 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 178.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 59.3 m -78.57 -36.04 45.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.701 0.8 . . . . 0.0 111.796 175.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mm100 -81.42 -32.96 32.46 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 117.428 -1.273 . . . . 0.0 114.421 -174.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -48.11 -47.92 64.75 Favored Pre-proline 0 N--CA 1.482 1.157 0 CA-C-N 120.667 1.576 . . . . 0.0 113.175 177.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -67.92 -32.26 29.29 Favored 'Trans proline' 0 C--N 1.354 0.827 0 CA-C-N 122.116 1.791 . . . . 0.0 113.811 173.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 58.6 mmtt -65.2 -30.78 71.71 Favored 'General case' 0 N--CA 1.476 0.849 0 O-C-N 120.584 -1.322 . . . . 0.0 113.456 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -67.55 -31.76 54.03 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.285 0.493 . . . . 0.0 111.267 174.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 53.6 mt -71.84 -50.77 36.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 124.564 1.146 . . . . 0.0 109.847 173.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -58.85 -39.96 82.84 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 123.414 0.686 . . . . 0.0 112.453 178.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -71.43 -27.44 63.29 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 118.828 0.74 . . . . 0.0 112.725 178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.2 m -73.84 -47.99 34.44 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.403 -0.811 . . . . 0.0 112.478 176.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -26.79 67.82 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 120.359 1.436 . . . . 0.0 114.832 -178.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -80.67 -16.93 52.75 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.579 1.696 . . . . 0.0 115.579 169.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -137.78 65.34 45.91 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 125.425 1.49 . . . . 0.0 111.463 174.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -64.12 -11.59 28.33 Favored 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.856 3.037 . . . . 0.0 115.923 -169.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -83.99 -17.1 41.62 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.014 1.325 . . . . 0.0 113.328 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -74.01 158.95 33.39 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.615 1.166 . . . . 0.0 111.545 -174.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -80.63 154.05 27.61 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 121.674 -0.641 . . . . 0.0 110.094 172.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 59.4 tp -66.3 -44.9 82.18 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.24 -0.913 . . . . 0.0 113.044 176.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -77.55 -19.77 55.19 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -169.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 12.6 t -64.45 -16.4 62.36 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.738 -1.226 . . . . 0.0 112.412 169.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -67.56 -2.97 7.47 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.348 -2.095 . . . . 0.0 113.499 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.99 -27.95 35.71 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.28 1.432 . . . . 0.0 112.293 167.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -64.36 -35.44 80.89 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.899 1.28 . . . . 0.0 112.049 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -72.1 -28.35 63.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.445 1.898 . . . . 0.0 115.403 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -104.55 102.14 11.77 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 115.095 1.517 . . . . 0.0 115.095 -166.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 55.8 m -84.21 79.18 9.62 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.688 1.195 . . . . 0.0 109.558 168.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . 0.555 HD22 ' CG ' ' B' ' 109' ' ' HIS . 53.9 t30 -73.24 170.43 15.01 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -169.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -71.38 91.63 1.02 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.63 1.572 . . . . 0.0 113.904 -173.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -141.89 161.11 53.15 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 127.119 2.168 . . . . 0.0 110.563 170.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -58.88 130.33 36.26 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 122.55 2.167 . . . . 0.0 112.078 176.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 6.8 p30 . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.791 1.636 . . . . 0.0 112.636 -174.802 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.262 14.2 t-20 69.14 71.0 0.26 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-O 124.053 1.882 . . . . 0.0 111.74 -177.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -123.12 156.13 35.6 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 130.868 3.667 . . . . 0.0 103.614 168.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 m -94.9 87.72 5.06 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 125.331 1.452 . . . . 0.0 112.458 -163.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.29 -34.55 70.66 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 121.026 1.739 . . . . 0.0 110.706 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -20.52 62.82 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 127.72 2.408 . . . . 0.0 113.969 176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -125.16 18.35 8.36 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.338 1.455 . . . . 0.0 112.145 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 59.7 ttm -60.62 119.67 8.55 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 169.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.68 154.8 36.29 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 121.069 -1.02 . . . . 0.0 109.458 -178.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.4 -34.62 75.66 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 120.466 -1.396 . . . . 0.0 112.951 -173.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -63.06 -34.62 77.98 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 172.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -76.14 -37.84 57.5 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.225 1.41 . . . . 0.0 111.253 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -62.14 -48.69 78.98 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.207 -0.933 . . . . 0.0 112.343 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.0 pt -70.35 -2.22 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 C-N-CA 123.671 0.788 . . . . 0.0 112.672 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -107.62 -15.33 14.61 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.86 1.664 . . . . 0.0 113.684 172.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.24 159.13 24.42 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.02 -1.05 . . . . 0.0 110.261 169.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.606 HD21 ' HD3' ' A' ' 19' ' ' LYS . 47.9 t-20 -67.01 128.09 93.75 Favored Pre-proline 0 N--CA 1.478 0.961 0 O-C-N 121.269 -0.894 . . . . 0.0 109.346 177.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -65.68 -20.72 59.47 Favored 'Trans proline' 0 N--CA 1.444 -1.397 0 C-N-CA 122.48 2.12 . . . . 0.0 111.636 -173.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.8 mptt -48.79 -52.44 23.93 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-N 120.273 1.397 . . . . 0.0 108.697 169.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -81.66 0.04 40.45 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 116.481 2.03 . . . . 0.0 116.481 177.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 31.6 mtt -65.89 -49.71 67.09 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 120.121 1.328 . . . . 0.0 112.199 173.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.25 -54.69 11.22 Favored Pre-proline 0 N--CA 1.49 1.564 0 N-CA-C 115.354 1.613 . . . . 0.0 115.354 -176.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -60.05 -42.38 44.46 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.324 2.016 . . . . 0.0 113.725 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.402 HG22 ' HG2' ' B' ' 102' ' ' PRO . 12.0 t -63.2 -45.82 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-N 119.336 0.971 . . . . 0.0 111.023 177.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.61 91.13 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.71 1.204 . . . . 0.0 111.109 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 73.8 t90 -68.87 -52.99 23.89 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-O 117.794 -1.098 . . . . 0.0 112.651 170.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.425 ' CH2' ' HB3' ' B' ' 105' ' ' TRP . 0.0 OUTLIER -51.57 -41.73 61.37 Favored 'General case' 0 C--N 1.347 0.486 0 CA-C-O 122.428 1.109 . . . . 0.0 111.491 -174.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -66.18 -44.29 84.42 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 125.488 1.515 . . . . 0.0 112.143 179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -25.28 67.86 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.469 ' CD2' HD21 ' A' ' 75' ' ' ASN . 74.9 m-70 -107.7 -14.12 14.88 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 174.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 64.83 156.64 0.08 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 126.657 1.983 . . . . 0.0 112.386 -167.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -68.36 11.82 0.15 Allowed 'General case' 0 N--CA 1.482 1.167 0 O-C-N 120.012 -1.68 . . . . 0.0 114.823 178.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 t -71.0 158.21 36.91 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.109 1.763 . . . . 0.0 113.452 -173.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.1 t -79.39 135.95 24.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 125.033 1.333 . . . . 0.0 109.643 174.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.46 168.84 18.91 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -169.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.82 -151.14 0.41 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.908 1.683 . . . . 0.0 111.332 -169.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.59 -21.32 72.65 Favored Glycine 0 CA--C 1.541 1.71 0 C-N-CA 124.114 0.864 . . . . 0.0 115.152 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -88.6 170.41 38.49 Favored Glycine 0 CA--C 1.537 1.447 0 CA-C-N 118.582 1.191 . . . . 0.0 113.629 174.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -107.4 12.24 28.17 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.124 1.37 . . . . 0.0 112.793 174.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.4 p -71.16 23.07 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.724 2.12 . . . . 0.0 116.724 -168.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.7 m -59.4 -22.85 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 C-N-CA 123.655 0.782 . . . . 0.0 111.192 166.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -49.32 141.41 8.77 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 126.036 1.734 . . . . 0.0 112.569 169.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 54.2 mt -57.27 135.47 56.47 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 167.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -139.82 160.67 39.36 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.359 2.263 . . . . 0.0 109.854 -169.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.16 -18.57 64.58 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 119.547 -1.97 . . . . 0.0 114.497 -168.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 37.5 m -70.77 -58.54 3.52 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 121.901 -0.499 . . . . 0.0 110.719 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.5 p30 -65.89 -30.73 71.38 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.811 1.187 . . . . 0.0 113.198 -179.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.9 mt -65.97 -27.69 68.34 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.773 1.169 . . . . 0.0 111.963 175.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.0 m -74.55 -36.99 63.12 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 122.701 0.4 . . . . 0.0 110.33 169.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.7 mm100 -84.09 -27.24 28.38 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -174.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.94 -41.02 77.1 Favored Pre-proline 0 CA--C 1.551 0.992 0 CA-C-N 121.212 1.824 . . . . 0.0 112.489 176.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -73.48 -38.0 2.82 Favored 'Trans proline' 0 C--N 1.353 0.777 0 CA-C-N 122.301 1.858 . . . . 0.0 113.432 168.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -66.95 -30.68 70.88 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.509 -1.37 . . . . 0.0 113.802 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.9 m -70.47 -20.98 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.097 0.862 . . . . 0.0 112.556 173.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 13.0 mt -81.78 -50.73 16.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 O-C-N 121.48 -0.763 . . . . 0.0 110.242 171.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.38 -41.81 85.65 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.835 0.854 . . . . 0.0 111.747 177.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -70.89 -22.75 62.24 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.994 -1.066 . . . . 0.0 111.725 -179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.5 m -79.44 -45.25 19.8 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 118.052 -0.975 . . . . 0.0 112.498 172.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -27.49 68.89 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 120.825 1.648 . . . . 0.0 113.761 173.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 29.1 mttt -69.15 -38.15 78.63 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 168.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 m-80 -128.74 68.44 78.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.791 1.236 . . . . 0.0 112.143 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -55.59 -15.8 13.09 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.471 2.781 . . . . 0.0 115.883 -179.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -80.14 -25.05 40.03 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.918 1.687 . . . . 0.0 113.268 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -75.55 162.89 27.9 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.07 1.348 . . . . 0.0 112.186 -170.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -77.34 150.6 35.17 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.584 -0.697 . . . . 0.0 109.175 168.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 61.7 tp -67.28 -33.85 76.18 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 174.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -88.78 -22.59 23.2 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 116.218 1.933 . . . . 0.0 116.218 -169.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.7 t -59.74 -21.09 60.23 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 121.508 -0.745 . . . . 0.0 111.842 169.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -58.57 -14.62 8.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 119.529 -1.982 . . . . 0.0 113.747 171.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -34.33 72.7 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.101 1.319 . . . . 0.0 111.845 166.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.7 -25.51 66.57 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.663 0.744 . . . . 0.0 112.447 -170.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -66.65 -33.85 76.57 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.602 1.961 . . . . 0.0 113.938 174.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -99.97 134.29 43.11 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -165.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.9 p -76.43 -50.75 13.3 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.177 0.991 . . . . 0.0 112.148 171.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.469 HD21 ' CD2' ' A' ' 30' ' ' HIS . 15.4 t-20 61.53 164.9 0.09 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 127.778 2.431 . . . . 0.0 114.188 -177.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -85.05 17.31 2.98 Favored 'General case' 0 CA--C 1.551 0.991 0 N-CA-C 116.348 1.981 . . . . 0.0 116.348 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.55 158.11 88.54 Favored Pre-proline 0 CA--C 1.553 1.09 0 O-C-N 120.906 -1.121 . . . . 0.0 112.598 171.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_exo -58.7 151.97 59.69 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.177 2.584 . . . . 0.0 114.185 176.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 2.9 t30 . . . . . 0 C--O 1.253 1.269 0 C-N-CA 125.036 1.334 . . . . 0.0 112.596 178.817 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 121.644 0.735 . . . . 0.0 111.874 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -132.41 55.78 1.87 Allowed 'General case' 0 C--O 1.211 -0.94 1 N-CA-C 99.345 -4.317 . . . . 0.0 99.345 166.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.272 9.6 mt-10 62.86 -175.26 0.15 Allowed 'General case' 0 CA--C 1.558 1.276 0 O-C-N 120.962 -1.086 . . . . 0.0 109.041 -164.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . 0.58 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 37.1 t -129.33 113.18 14.66 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.982 1.713 . . . . 0.0 113.804 -169.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . 0.444 ' HB2' ' O ' ' A' ' 19' ' ' LYS . . . -61.34 -32.59 72.48 Favored 'General case' 0 CA--C 1.548 0.877 0 O-C-N 119.702 -1.874 . . . . 0.0 111.354 169.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -62.18 -24.16 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.814 2.045 . . . . 0.0 114.048 177.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -115.64 11.43 15.78 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.368 1.467 . . . . 0.0 113.369 176.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 51.3 ttm -62.88 125.44 23.97 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.644 -1.285 . . . . 0.0 109.939 171.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.1 t -77.71 155.66 31.14 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.04 -1.038 . . . . 0.0 110.487 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.8 -32.01 73.5 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.163 -1.585 . . . . 0.0 113.186 -172.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -64.44 -30.94 71.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.804 0.729 . . . . 0.0 112.663 171.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -81.53 -33.88 31.52 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.859 1.664 . . . . 0.0 111.32 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -64.12 -48.51 75.8 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.854 0.861 . . . . 0.0 112.987 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.1 pt -68.9 -4.12 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 176.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -104.98 -11.48 16.64 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 126.222 1.809 . . . . 0.0 114.081 172.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.68 158.41 36.2 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 119.928 1.24 . . . . 0.0 110.856 175.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 44.1 t-20 -64.45 132.88 95.5 Favored Pre-proline 0 CA--C 1.551 1.003 0 O-C-N 121.246 -0.909 . . . . 0.0 111.871 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 25.4 Cg_exo -63.81 -15.03 46.58 Favored 'Trans proline' 0 CA--C 1.547 1.136 0 C-N-CA 122.921 2.414 . . . . 0.0 114.5 -178.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mptt -55.51 -67.22 0.3 Allowed 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.325 1.45 . . . . 0.0 108.868 167.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . 0.434 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -74.91 -14.35 60.64 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -175.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 33.3 ttm -56.48 -34.56 67.03 Favored 'General case' 0 N--CA 1.477 0.915 0 O-C-N 120.882 -1.136 . . . . 0.0 113.081 175.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 41.5 m -63.16 -58.15 17.45 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.402 ' HG2' HG22 ' A' ' 24' ' ' VAL . 18.5 Cg_endo -55.42 -39.11 92.83 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 123.486 2.791 . . . . 0.0 112.469 169.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.434 HG23 ' O ' ' B' ' 99' ' ' ALA . 68.9 t -60.74 -43.69 95.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 O-C-N 120.059 -1.651 . . . . 0.0 111.478 176.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.18 -40.01 86.52 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 118.461 -0.78 . . . . 0.0 111.554 -175.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.425 ' HB3' ' CH2' ' A' ' 27' ' ' TRP 0.276 0.0 OUTLIER -74.61 -42.52 58.49 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 116.674 -1.631 . . . . 0.0 111.021 175.042 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.497 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 0.2 OUTLIER -65.84 -22.5 66.55 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 122.353 2.342 . . . . 0.0 114.15 176.907 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 3.9 ttp -76.3 -49.45 16.93 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.387 1.075 . . . . 0.0 111.263 169.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -68.38 -32.92 73.34 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.649 0.779 . . . . 0.0 112.293 -175.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -96.78 2.39 51.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.887 1.675 . . . . 0.0 113.82 170.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 38.0 58.1 1.5 Allowed 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 126.47 1.908 . . . . 0.0 114.596 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 55.24 12.63 0.71 Allowed 'General case' 0 CA--C 1.561 1.373 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 176.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 4.9 t -64.7 157.25 27.86 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.969 1.47 . . . . 0.0 114.969 -169.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 1.4 p -86.42 157.22 3.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 124.675 1.19 . . . . 0.0 108.209 168.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . 0.297 0.5 OUTLIER -101.59 10.27 40.39 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -168.282 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 37.72 54.03 1.5 Allowed 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 126.99 2.116 . . . . 0.0 115.469 168.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.25 -4.96 82.29 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 125.884 1.706 . . . . 0.0 116.02 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.62 170.0 54.57 Favored Glycine 0 CA--C 1.536 1.39 0 CA-C-N 119.248 1.524 . . . . 0.0 114.155 174.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -120.79 -12.57 8.81 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.062 1.345 . . . . 0.0 114.12 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 2.7 p -77.16 32.44 0.15 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.964 1.706 . . . . 0.0 115.138 -172.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -65.03 -16.22 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.045 1.338 . . . . 0.0 112.407 168.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.27 152.86 4.19 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.248 1.419 . . . . 0.0 110.606 167.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 26.0 mt -70.61 83.57 0.61 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 122.593 1.187 . . . . 0.0 110.499 170.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -62.58 162.53 10.33 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.658 2.383 . . . . 0.0 111.121 169.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.33 -26.01 66.28 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.035 -1.041 . . . . 0.0 113.606 -170.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 96.7 m -63.61 -49.24 74.08 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 118.682 0.674 . . . . 0.0 110.571 169.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 88.7 m-20 -66.56 -41.47 88.56 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.381 -0.824 . . . . 0.0 112.072 178.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 97.6 mt -57.17 -30.58 64.61 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.272 0.942 . . . . 0.0 112.584 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 43.7 m -79.21 -36.73 39.67 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.695 0.798 . . . . 0.0 111.77 173.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -83.46 -29.74 27.78 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -175.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.67 -44.79 91.06 Favored Pre-proline 0 CA--C 1.553 1.069 0 CA-C-N 120.53 1.514 . . . . 0.0 112.526 176.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.95 -34.79 10.12 Favored 'Trans proline' 0 C--N 1.352 0.755 0 CA-C-N 122.363 1.88 . . . . 0.0 113.561 171.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -65.6 -33.6 76.27 Favored 'General case' 0 N--CA 1.479 1.007 0 O-C-N 120.392 -1.442 . . . . 0.0 113.562 -179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 21.6 m -72.03 -28.59 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 118.562 0.619 . . . . 0.0 111.792 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.7 mt -71.31 -48.22 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.5 171.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -54.92 -44.89 74.63 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.15 0.98 . . . . 0.0 111.66 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -65.57 -32.58 74.25 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.436 -0.79 . . . . 0.0 112.383 -178.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.6 m -70.77 -47.1 61.35 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 120.948 -1.095 . . . . 0.0 112.443 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.79 -29.98 67.42 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-N 120.568 1.531 . . . . 0.0 114.512 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 24.6 pttt -78.69 -23.59 45.51 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -134.64 73.22 68.05 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 125.017 1.327 . . . . 0.0 111.91 171.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -61.04 -12.71 23.93 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.705 2.937 . . . . 0.0 117.208 -173.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -80.3 -21.52 42.52 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.587 1.155 . . . . 0.0 113.22 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 53.1 mmtt -63.56 152.73 37.87 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.766 0.827 . . . . 0.0 111.795 -175.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -85.97 132.17 34.13 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 66.8 tp -49.8 -43.51 48.58 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -168.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -75.93 -7.9 55.67 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.852 -1.155 . . . . 0.0 113.982 -174.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 58.8 p -57.54 -25.98 60.72 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.343 -1.473 . . . . 0.0 111.38 168.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -70.76 -1.99 13.27 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.794 1.237 . . . . 0.0 113.914 177.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.05 -32.44 50.87 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 124.65 1.18 . . . . 0.0 111.611 166.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -66.31 -28.5 68.73 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.506 1.122 . . . . 0.0 112.887 -168.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -73.56 -30.07 62.81 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.693 1.997 . . . . 0.0 115.757 169.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -94.73 123.56 38.26 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.491 1.116 . . . . 0.0 113.856 -167.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 27.6 m -103.69 -2.62 26.24 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -179.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -87.48 8.63 23.97 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -81.99 41.28 0.66 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 126.663 1.985 . . . . 0.0 114.413 -173.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.71 158.48 29.34 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 127.28 2.232 . . . . 0.0 111.918 -178.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -65.77 154.77 72.46 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 122.64 2.227 . . . . 0.0 112.401 169.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 . . . . . 0 C--O 1.253 1.287 0 C-N-CA 125.769 1.628 . . . . 0.0 112.31 179.538 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.294 0.2 OUTLIER 69.51 35.63 2.45 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.744 1.617 . . . . 0.0 114.511 172.683 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -76.5 164.19 26.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 128.181 2.592 . . . . 0.0 106.08 164.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.1 t -105.06 108.89 20.65 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 120.765 -1.209 . . . . 0.0 112.66 -166.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.559 ' HB2' ' O ' ' B' ' 98' ' ' LYS . . . -63.27 -29.8 71.06 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.796 -1.19 . . . . 0.0 111.209 170.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 14.5 mtmt -60.25 -44.62 95.11 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.527 1.131 . . . . 0.0 112.281 175.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -99.33 15.02 27.59 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.807 1.243 . . . . 0.0 113.982 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 57.2 ttm -60.78 126.14 26.3 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.0 t -78.57 154.75 30.1 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 120.288 -1.508 . . . . 0.0 110.491 176.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -61.51 -34.0 74.76 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 120.314 -1.491 . . . . 0.0 112.968 -175.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -62.1 -31.61 72.09 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.791 0.836 . . . . 0.0 113.251 171.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -80.49 -36.03 33.93 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.402 1.481 . . . . 0.0 111.348 175.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -59.86 -48.85 80.01 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.354 -0.841 . . . . 0.0 111.981 175.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.0 pt -71.51 -2.11 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 C-N-CA 125.056 1.342 . . . . 0.0 113.246 176.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -104.64 -13.02 16.11 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.343 1.457 . . . . 0.0 113.155 170.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.82 158.6 35.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.313 1.045 . . . . 0.0 111.31 175.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 7.1 t-20 -64.65 139.7 97.83 Favored Pre-proline 0 N--CA 1.48 1.026 0 C-N-CA 123.719 0.808 . . . . 0.0 112.443 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' ASN 0.284 12.1 Cg_exo -78.39 -9.7 16.21 Favored 'Trans proline' 0 CA--C 1.547 1.173 0 CA-C-N 120.809 1.325 . . . . 0.0 114.31 -174.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.602 ' HB2' ' HE2' ' B' ' 87' ' ' MET . 28.6 mttp -66.54 -54.22 26.11 Favored 'General case' 0 C--N 1.356 0.867 0 CA-C-N 120.338 1.426 . . . . 0.0 107.521 166.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.505 ' HB1' HG21 ' B' ' 103' ' ' VAL . . . -79.16 -5.92 55.32 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.5 mtt -58.64 -51.84 68.23 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.351 0.978 . . . . 0.0 111.821 170.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.3 m -54.53 -49.82 88.85 Favored Pre-proline 0 N--CA 1.482 1.159 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -173.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.501 ' HG2' HG22 ' B' ' 103' ' ' VAL . 9.8 Cg_endo -53.5 -45.95 37.29 Favored 'Trans proline' 0 N--CA 1.476 0.489 0 C-N-CA 123.227 2.618 . . . . 0.0 116.47 170.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.0 p -73.31 -41.28 57.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 O-C-N 120.841 -1.162 . . . . 0.0 112.469 178.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.26 -27.96 67.68 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.371 1.068 . . . . 0.0 111.125 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 57.6 t90 -82.0 -51.13 8.35 Favored 'General case' 0 C--N 1.344 0.367 0 CA-C-O 117.189 -1.386 . . . . 0.0 113.103 170.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.473 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.9 t90 -62.96 -31.43 72.53 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 120.652 1.569 . . . . 0.0 110.797 -168.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 62.4 ttp -57.68 -51.88 67.73 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.041 1.336 . . . . 0.0 112.12 167.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.49 -28.84 68.88 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.374 1.47 . . . . 0.0 113.887 -175.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -114.07 -26.86 7.9 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -173.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 67.28 142.28 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 128.826 2.851 . . . . 0.0 117.373 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.4 tm-20 -72.73 -16.66 61.66 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.312 1.445 . . . . 0.0 113.504 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 66.2 p -71.62 29.25 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 128.556 2.742 . . . . 0.0 116.524 -168.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 58.0 t 67.96 138.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 128.629 2.772 . . . . 0.0 114.194 173.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -90.11 17.98 6.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.531 1.532 . . . . 0.0 114.509 -169.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . 0.323 0.2 OUTLIER 39.29 45.92 1.23 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 128.306 2.642 . . . . 0.0 114.793 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.37 5.0 89.96 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 125.726 1.631 . . . . 0.0 115.611 174.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.01 166.44 54.72 Favored Glycine 0 CA--C 1.535 1.303 0 CA-C-N 118.661 1.23 . . . . 0.0 114.263 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -115.99 -177.39 3.15 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.502 1.521 . . . . 0.0 112.271 172.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 8.3 m 58.22 41.11 24.06 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 122.765 1.269 . . . . 0.0 111.4 -169.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 15.2 m -66.27 -7.61 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.14 0.976 . . . . 0.0 112.364 168.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.39 147.8 5.59 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 126.92 2.088 . . . . 0.0 111.956 170.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -62.19 115.66 4.33 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 167.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -120.9 177.08 5.24 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.451 1.1 . . . . 0.0 113.245 -168.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -67.72 -21.38 65.3 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.762 -1.211 . . . . 0.0 114.089 -171.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 99.4 m -67.45 -42.86 82.38 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.2 0.909 . . . . 0.0 110.279 169.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -62.53 -47.84 82.13 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.641 -0.662 . . . . 0.0 110.697 173.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 81.6 mt -63.56 -26.05 68.52 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.058 -1.026 . . . . 0.0 112.501 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 95.3 m -75.27 -38.75 60.32 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.015 0.526 . . . . 0.0 110.958 171.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -86.91 -27.91 23.09 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 118.041 -0.981 . . . . 0.0 113.628 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . 0.25 1.6 mp -51.78 -43.63 88.83 Favored Pre-proline 0 CA--C 1.551 0.998 0 CA-C-N 120.641 1.564 . . . . 0.0 113.005 175.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -69.21 -39.56 7.4 Favored 'Trans proline' 0 C--N 1.351 0.675 0 CA-C-N 122.054 1.769 . . . . 0.0 113.555 169.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -63.64 -37.52 87.65 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 119.431 1.014 . . . . 0.0 112.909 -176.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.49 -26.23 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 177.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 18.6 mt -73.74 -52.47 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 121.776 -0.578 . . . . 0.0 110.195 173.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -55.45 -49.27 72.89 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.611 0.765 . . . . 0.0 110.502 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -65.45 -25.51 67.55 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.514 -0.741 . . . . 0.0 112.019 -176.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -78.67 -47.98 15.91 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.125 0.875 . . . . 0.0 112.295 173.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -26.68 68.4 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 120.662 1.574 . . . . 0.0 113.748 174.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.2 mtpp -72.75 -29.03 62.99 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.778 1.631 . . . . 0.0 114.492 169.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -135.04 66.79 68.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.138 1.375 . . . . 0.0 112.397 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -57.65 -13.55 14.46 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 123.514 2.809 . . . . 0.0 116.914 -174.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -83.97 -21.06 31.88 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.226 1.41 . . . . 0.0 113.762 -178.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -69.06 156.0 39.39 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.928 0.891 . . . . 0.0 111.775 -171.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -92.84 122.75 35.54 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 54.7 tp -42.69 -52.9 4.74 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -165.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.411 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.4 m-85 -68.32 -8.11 36.94 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -173.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 82.7 p -55.69 -28.16 54.12 Favored 'General case' 0 N--CA 1.48 1.065 0 O-C-N 121.021 -1.049 . . . . 0.0 111.294 167.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -71.99 -1.22 13.77 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.642 1.577 . . . . 0.0 114.336 179.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -31.61 25.89 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 120.183 1.356 . . . . 0.0 110.936 166.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.53 -26.65 64.62 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.937 0.895 . . . . 0.0 111.909 -170.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -72.97 -28.99 62.73 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.553 1.541 . . . . 0.0 114.937 171.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -101.32 103.82 14.8 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.165 1.386 . . . . 0.0 113.78 -167.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 51.0 m -78.84 79.94 5.22 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.477 1.111 . . . . 0.0 110.685 171.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -70.67 172.28 8.94 Favored 'General case' 0 CA--C 1.555 1.173 0 C-N-CA 124.68 1.192 . . . . 0.0 112.314 -176.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -74.5 29.12 0.08 Allowed 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 116.75 2.13 . . . . 0.0 116.75 -168.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.07 152.9 79.81 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 125.13 1.372 . . . . 0.0 112.395 173.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -70.56 162.57 42.01 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.995 2.463 . . . . 0.0 112.139 170.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.343 0 C-N-CA 125.786 1.634 . . . . 0.0 112.175 179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.102 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.332 10.4 t-20 72.59 26.21 2.52 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.735 1.614 . . . . 0.0 114.753 176.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.501 ' HB3' ' HG2' ' A' ' 19' ' ' LYS . 3.2 mm-40 -74.25 159.18 32.82 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.779 2.431 . . . . 0.0 105.376 163.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 23.1 t -105.38 103.51 13.05 Favored 'General case' 0 CA--C 1.51 -0.559 0 O-C-N 120.264 -1.523 . . . . 0.0 113.746 -164.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.21 -35.68 67.59 Favored 'General case' 0 CA--C 1.551 1.01 0 O-C-N 120.758 -1.214 . . . . 0.0 110.275 170.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -66.53 -20.61 66.07 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.398 2.279 . . . . 0.0 115.512 179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -123.65 9.4 8.94 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.628 1.171 . . . . 0.0 113.213 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . 0.602 ' HE2' ' HB2' ' A' ' 19' ' ' LYS . 27.9 ttm -61.4 134.04 56.47 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 120.552 -1.342 . . . . 0.0 109.858 169.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 9.3 p -71.81 169.85 14.88 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 121.948 0.88 . . . . 0.0 112.381 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 2.2 m -70.37 -38.68 74.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.933 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 16.7 tp60 -63.78 -37.73 88.45 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.416 1.007 . . . . 0.0 112.37 173.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -73.12 -39.03 66.09 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.483 1.113 . . . . 0.0 111.598 175.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -61.5 -49.46 76.66 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.431 -0.793 . . . . 0.0 113.105 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.3 pt -68.41 -4.72 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.922 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 176.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -105.9 -10.75 16.48 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.282 1.833 . . . . 0.0 114.058 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 158.84 34.72 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 119.767 1.167 . . . . 0.0 110.887 176.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -58.11 134.21 84.18 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.186 0.995 . . . . 0.0 113.164 177.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -70.95 -16.86 32.49 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 122.693 2.262 . . . . 0.0 115.686 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.559 ' O ' ' HB2' ' A' ' 5' ' ' ALA . 9.0 mptt -63.7 -49.23 73.93 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 121.003 1.729 . . . . 0.0 109.716 170.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . 0.487 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -86.38 -16.03 38.58 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.4 ttm -54.6 -34.86 62.68 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.462 -1.399 . . . . 0.0 113.236 175.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 56.3 m -65.58 -57.38 14.61 Favored Pre-proline 0 N--CA 1.481 1.118 0 CA-C-O 117.535 -1.222 . . . . 0.0 112.911 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -52.79 -38.72 78.25 Favored 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 123.881 3.054 . . . . 0.0 114.444 169.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.505 HG21 ' HB1' ' A' ' 20' ' ' ALA . 58.4 t -62.83 -52.61 57.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 O-C-N 121.9 -0.5 . . . . 0.0 111.286 176.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.94 -40.99 95.37 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.291 1.037 . . . . 0.0 110.842 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 82.5 t90 -68.19 -50.04 56.89 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.577 -1.201 . . . . 0.0 112.626 175.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.414 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.2 t90 -67.77 -29.91 69.23 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 120.746 1.612 . . . . 0.0 111.56 -168.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.8 tmm? -60.41 -48.5 81.49 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.578 1.151 . . . . 0.0 111.577 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.9 -24.84 60.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.89 1.276 . . . . 0.0 113.18 -178.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -136.8 85.6 2.15 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.949 1.699 . . . . 0.0 109.652 -177.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -48.67 154.69 0.65 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 127.282 2.233 . . . . 0.0 117.008 -169.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -71.27 1.25 6.35 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.335 2.254 . . . . 0.0 115.519 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 6.5 t -71.23 171.54 10.89 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.417 1.487 . . . . 0.0 112.607 177.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -92.18 141.34 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 124.413 1.085 . . . . 0.0 111.758 -178.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -81.35 172.86 13.06 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.967 0.907 . . . . 0.0 113.022 -176.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.72 138.19 50.99 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.749 1.62 . . . . 0.0 109.976 169.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.66 -3.22 44.05 Favored Glycine 0 CA--C 1.542 1.774 0 N-CA-C 117.106 1.602 . . . . 0.0 117.106 179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -171.72 -169.3 34.4 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-N 119.936 1.868 . . . . 0.0 115.318 178.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -133.68 32.84 3.54 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 126.766 2.026 . . . . 0.0 113.406 -169.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 22.4 p -74.32 60.37 0.83 Allowed 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 127.068 2.147 . . . . 0.0 115.32 -168.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 35.7 m -69.26 -8.9 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.434 1.094 . . . . 0.0 112.171 167.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.9 153.68 8.27 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 129.569 3.148 . . . . 0.0 114.024 171.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -74.13 127.18 32.27 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.621 0.768 . . . . 0.0 109.968 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -91.22 161.12 15.19 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.568 1.147 . . . . 0.0 109.974 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.99 -26.93 68.79 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 120.419 -1.425 . . . . 0.0 112.001 174.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 32.9 m -60.83 -42.21 97.29 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.222 1.009 . . . . 0.0 111.107 168.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -66.31 -50.02 65.06 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.196 0.907 . . . . 0.0 110.732 174.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -56.01 -32.61 64.12 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.748 0.819 . . . . 0.0 112.265 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 26.1 m -80.86 -38.53 27.98 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.648 0.779 . . . . 0.0 112.287 173.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -78.0 -31.83 50.84 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 117.321 -1.324 . . . . 0.0 114.452 -175.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.51 -46.37 90.55 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 121.2 1.818 . . . . 0.0 112.998 -179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.25 -38.54 8.77 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 121.941 1.729 . . . . 0.0 113.428 172.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -67.54 -31.73 72.02 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.746 -1.221 . . . . 0.0 113.773 -175.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 29.3 m -72.3 -26.86 25.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 118.384 0.538 . . . . 0.0 111.994 174.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 39.7 mt -71.0 -50.18 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 123.701 0.8 . . . . 0.0 109.715 171.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -56.93 -45.48 82.7 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.759 0.824 . . . . 0.0 111.813 175.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -67.88 -24.87 65.28 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 120.653 -1.279 . . . . 0.0 112.299 -178.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.9 -46.94 19.89 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.916 0.78 . . . . 0.0 112.207 176.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -26.19 68.04 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 120.363 1.438 . . . . 0.0 113.981 174.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 29.7 mttt -68.92 -31.1 69.77 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 168.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -133.05 63.83 68.27 Favored Pre-proline 0 CA--C 1.548 0.889 0 C-N-CA 124.872 1.269 . . . . 0.0 112.322 -177.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -56.9 -20.03 34.43 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.166 2.578 . . . . 0.0 116.435 -171.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -80.2 -16.77 54.07 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.605 1.162 . . . . 0.0 113.283 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -74.25 165.89 24.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.612 1.165 . . . . 0.0 112.219 -172.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -80.46 151.57 29.21 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 169.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 49.2 tp -68.56 -38.97 81.21 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 176.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -85.2 -20.16 30.59 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 115.712 1.745 . . . . 0.0 115.712 -169.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.8 t -62.06 -16.47 52.23 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.048 -1.033 . . . . 0.0 112.127 171.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -65.5 -4.04 5.31 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 119.512 -1.992 . . . . 0.0 114.336 168.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.13 -28.35 35.16 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.293 1.437 . . . . 0.0 111.988 166.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -65.17 -35.47 81.19 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.175 1.39 . . . . 0.0 112.075 -174.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -70.78 -28.22 64.5 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.348 1.859 . . . . 0.0 114.948 173.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.95 102.66 12.74 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.599 1.333 . . . . 0.0 114.599 -167.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 46.1 m -79.03 70.43 5.37 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.574 1.15 . . . . 0.0 110.542 169.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -66.91 165.12 16.07 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.056 1.343 . . . . 0.0 112.422 -177.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -70.29 138.72 51.79 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -171.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.8 mp -133.03 150.53 75.83 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 125.876 1.67 . . . . 0.0 109.219 168.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -65.87 165.38 23.76 Favored 'Trans proline' 0 CA--C 1.542 0.899 0 C-N-CA 122.596 2.197 . . . . 0.0 114.659 179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 127.012 2.125 . . . . 0.0 113.951 178.483 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.975 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.257 8.4 t-20 60.0 40.43 18.79 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.902 1.681 . . . . 0.0 115.096 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -62.18 -24.53 67.25 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.243 1.017 . . . . 0.0 112.681 168.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t 93.75 104.4 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 128.982 2.913 . . . . 0.0 117.45 167.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.49 -29.06 68.83 Favored 'General case' 0 CA--C 1.553 1.076 0 O-C-N 119.855 -1.778 . . . . 0.0 112.306 169.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 7.7 mtmt -65.28 -30.85 71.75 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.145 1.378 . . . . 0.0 114.118 174.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -100.8 4.95 43.32 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.479 1.111 . . . . 0.0 113.077 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 38.9 ttm -63.89 139.83 58.81 Favored 'General case' 0 C--N 1.348 0.528 0 CA-C-N 119.604 1.093 . . . . 0.0 110.487 172.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 4.3 p -78.44 175.88 9.89 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.038 -1.038 . . . . 0.0 112.247 173.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.31 -39.72 53.36 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.702 171.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -61.78 -35.96 79.69 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.11 0.868 . . . . 0.0 112.23 171.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -75.72 -38.55 58.45 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.66 1.184 . . . . 0.0 111.948 176.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -57.5 -50.58 72.6 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 121.478 -0.764 . . . . 0.0 112.792 176.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.9 pt -68.26 -4.79 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 C-N-CA 124.094 0.958 . . . . 0.0 112.519 178.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -106.98 -13.61 15.16 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.337 1.455 . . . . 0.0 114.291 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.73 163.77 27.18 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 120.892 -1.13 . . . . 0.0 111.048 173.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.49 HD21 ' HD3' ' A' ' 19' ' ' LYS . 44.0 t-20 -65.07 131.52 95.19 Favored Pre-proline 0 N--CA 1.484 1.23 0 O-C-N 120.683 -1.261 . . . . 0.0 112.531 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -59.94 -16.16 37.08 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 123.82 3.014 . . . . 0.0 115.669 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.49 ' HD3' HD21 ' A' ' 17' ' ' ASN . 4.9 mptt -58.17 -65.49 0.64 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 125.776 1.631 . . . . 0.0 108.899 167.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.456 ' O ' HG23 ' A' ' 24' ' ' VAL . . . -78.02 -9.61 59.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -177.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 83.7 mtp -58.1 -35.97 72.2 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 119.797 1.181 . . . . 0.0 112.749 171.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.5 m -64.19 -55.95 27.56 Favored Pre-proline 0 N--CA 1.484 1.236 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.23 -35.31 95.39 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 123.325 2.683 . . . . 0.0 114.224 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 20' ' ' ALA . 95.1 t -63.1 -52.36 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 123.392 0.677 . . . . 0.0 111.617 173.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.97 -39.32 91.76 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.045 1.338 . . . . 0.0 110.708 -178.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 72.4 t90 -67.74 -51.86 44.3 Favored 'General case' 0 C--N 1.34 0.156 0 CA-C-O 116.944 -1.503 . . . . 0.0 112.644 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.455 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 2.4 t90 -67.28 -25.05 65.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 120.973 1.715 . . . . 0.0 111.7 -169.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -67.66 -46.19 73.1 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.448 1.099 . . . . 0.0 111.702 169.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -41.21 98.39 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 174.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -110.84 90.6 3.38 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.712 1.205 . . . . 0.0 112.161 172.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 80.7 tt0 -65.19 144.93 56.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.501 1.92 . . . . 0.0 113.862 -169.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -69.67 3.76 2.3 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -178.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.7 t -75.24 30.47 0.1 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.897 2.079 . . . . 0.0 114.861 -170.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 77.8 t 62.78 128.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 128.933 2.893 . . . . 0.0 113.788 -171.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -79.36 170.11 17.09 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.927 1.291 . . . . 0.0 112.19 -178.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.86 138.03 49.65 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.942 1.297 . . . . 0.0 110.137 173.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 70.03 -43.65 0.52 Allowed Glycine 0 CA--C 1.542 1.72 0 C-N-CA 125.606 1.575 . . . . 0.0 114.653 -171.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 92.5 -171.11 33.16 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 125.525 1.536 . . . . 0.0 113.848 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.1 t70 62.11 -44.69 0.17 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 128.502 2.721 . . . . 0.0 117.315 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.4 m -71.28 6.14 1.87 Allowed 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.394 1.478 . . . . 0.0 114.744 -171.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.4 m -58.89 -10.77 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 126.26 1.824 . . . . 0.0 112.954 168.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 p -50.15 161.12 0.3 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.859 2.063 . . . . 0.0 113.48 169.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.7 mt -78.71 92.69 4.81 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.303 -0.873 . . . . 0.0 108.724 167.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -71.75 164.92 25.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.33 1.052 . . . . 0.0 109.717 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -65.19 -28.08 69.14 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.033 -1.667 . . . . 0.0 112.685 -176.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 51.9 m -63.48 -42.31 98.57 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 121.384 -0.823 . . . . 0.0 110.84 168.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -67.28 -42.45 83.76 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 120.963 -1.086 . . . . 0.0 110.584 177.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.57 -26.89 68.82 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.316 -0.865 . . . . 0.0 111.794 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 88.4 m -77.91 -36.21 49.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.221 1.008 . . . . 0.0 111.502 171.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.1 mm100 -82.99 -28.97 29.33 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 -177.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.31 -39.69 73.61 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-O 117.176 -1.392 . . . . 0.0 112.78 177.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.597 ' HA ' HD12 ' A' ' 55' ' ' ILE . 44.8 Cg_endo -73.98 -37.94 2.51 Favored 'Trans proline' 0 C--N 1.354 0.825 0 CA-C-N 122.307 1.859 . . . . 0.0 113.317 168.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.3 mmtt -66.46 -32.41 73.75 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.486 -1.383 . . . . 0.0 113.683 -176.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.62 -17.31 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.597 HD12 ' HA ' ' A' ' 52' ' ' PRO . 11.3 mt -83.45 -52.82 12.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 124.416 1.087 . . . . 0.0 109.633 172.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -56.41 -49.9 73.19 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 124.027 0.931 . . . . 0.0 110.735 177.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -62.34 -24.77 67.53 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.438 -0.789 . . . . 0.0 111.596 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.73 -47.39 14.03 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 118.138 -0.934 . . . . 0.0 112.397 175.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -27.87 69.58 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 120.848 1.658 . . . . 0.0 113.696 172.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 21.4 mtpp -73.02 -30.52 63.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.787 1.635 . . . . 0.0 115.115 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -131.59 66.62 78.64 Favored Pre-proline 0 CA--C 1.543 0.688 0 C-N-CA 125.227 1.411 . . . . 0.0 110.479 178.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -60.57 -14.36 30.5 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.592 2.861 . . . . 0.0 114.646 -174.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -79.12 -26.29 42.88 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.158 1.783 . . . . 0.0 112.685 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -69.17 162.71 26.48 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.65 1.18 . . . . 0.0 112.624 -169.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -94.82 131.4 40.74 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 174.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.2 tp -52.29 -35.81 51.28 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 -166.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 6' ' ' LYS 0.267 5.0 m-85 -82.55 -5.45 58.77 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.351 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 60.5 p -60.49 -27.81 67.87 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 120.168 -1.583 . . . . 0.0 111.357 168.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -70.6 -4.11 21.57 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.512 1.525 . . . . 0.0 114.114 177.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.85 -32.2 40.51 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.994 1.717 . . . . 0.0 111.316 169.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -72.7 -25.45 61.24 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.089 1.356 . . . . 0.0 112.176 -171.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -76.19 -31.59 58.55 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.14 -49.9 5.3 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -167.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 45.3 m 46.2 32.97 1.61 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 -178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -85.92 2.42 46.13 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 125.134 1.374 . . . . 0.0 114.346 -173.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 p-10 -94.06 53.32 1.74 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.404 1.882 . . . . 0.0 114.993 -166.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -159.31 160.02 28.5 Favored Pre-proline 0 CA--C 1.549 0.914 0 C-N-CA 126.433 1.893 . . . . 0.0 111.462 172.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -61.96 143.71 95.64 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 123.004 2.47 . . . . 0.0 112.081 168.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 124.927 1.291 . . . . 0.0 113.003 175.913 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.956 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . 0.307 0.3 OUTLIER 69.03 34.99 2.92 Favored 'General case' 0 N--CA 1.477 0.875 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 171.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -76.01 157.39 33.08 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 163.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 21.0 t -94.26 99.51 11.74 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 120.672 -1.268 . . . . 0.0 113.689 -166.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.32 -33.6 63.45 Favored 'General case' 0 CA--C 1.554 1.123 0 O-C-N 120.827 -1.17 . . . . 0.0 110.911 169.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.43 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 13.5 mtmt -62.54 -37.77 87.41 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.679 1.992 . . . . 0.0 114.199 176.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -106.63 12.82 28.91 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.927 1.291 . . . . 0.0 112.672 -178.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 60.2 ttm -58.48 132.17 52.93 Favored 'General case' 0 C--N 1.349 0.572 0 O-C-N 121.108 -0.995 . . . . 0.0 108.5 169.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 11.7 p -74.56 172.35 12.17 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.218 -0.926 . . . . 0.0 111.765 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.58 -36.22 73.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.94 170.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -63.67 -35.89 82.05 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 119.361 0.982 . . . . 0.0 112.462 171.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -78.01 -34.75 50.53 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.921 1.288 . . . . 0.0 111.885 178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . 0.538 ' HA ' HD12 ' B' ' 95' ' ' LEU . 93.6 t80 -68.7 -37.13 79.29 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 120.964 -1.085 . . . . 0.0 113.52 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.4 pt -77.64 3.8 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 O-C-N 120.844 -1.16 . . . . 0.0 112.026 173.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -120.03 -32.24 4.24 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -177.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' B' ' 92' ' ' PHE . 0.0 OUTLIER -64.42 162.81 14.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 121.231 1.832 . . . . 0.0 111.906 172.862 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.491 HD21 ' HD3' ' B' ' 98' ' ' LYS . 48.5 t-20 -63.69 132.22 95.13 Favored Pre-proline 0 N--CA 1.477 0.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.805 -168.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -55.0 -22.22 29.92 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.029 3.153 . . . . 0.0 115.378 176.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.491 ' HD3' HD21 ' B' ' 96' ' ' ASN . 14.6 mttt -56.64 -59.83 4.44 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.125 1.77 . . . . 0.0 109.365 167.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.75 -14.74 47.35 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 30.5 ttm -53.92 -36.18 62.48 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.947 0.899 . . . . 0.0 111.197 168.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 28.4 m -65.97 -57.65 13.01 Favored Pre-proline 0 N--CA 1.479 0.986 0 CA-C-O 117.862 -1.066 . . . . 0.0 112.818 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo -51.23 -41.79 56.68 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 123.983 3.122 . . . . 0.0 115.188 170.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 8.3 p -74.92 -37.8 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 CA-C-N 119.606 1.094 . . . . 0.0 113.289 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.16 -33.91 76.48 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.234 0.613 . . . . 0.0 111.047 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.52 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 84.6 t90 -75.91 -50.38 15.17 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-O 117.722 -1.132 . . . . 0.0 112.349 175.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.436 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 1.5 t90 -67.06 -25.51 66.29 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 117.924 -1.51 . . . . 0.0 111.16 -170.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 54.9 ttp -60.97 -53.36 58.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.638 1.175 . . . . 0.0 111.319 168.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.66 -31.64 66.5 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.775 1.23 . . . . 0.0 112.411 178.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -124.12 70.7 1.1 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.452 1.501 . . . . 0.0 112.295 175.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.36 -172.44 0.59 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -172.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 68.26 -2.25 1.6 Allowed 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 126.826 2.05 . . . . 0.0 114.942 -178.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 9.4 p 58.18 13.06 2.13 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 126.228 1.811 . . . . 0.0 114.621 -170.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 49.1 t -124.53 141.68 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 126.378 1.871 . . . . 0.0 110.217 -169.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -126.36 117.88 23.89 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.725 1.21 . . . . 0.0 110.55 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -123.5 -7.57 8.06 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 116.25 1.944 . . . . 0.0 116.25 -169.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -82.72 -12.0 80.74 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 124.261 0.934 . . . . 0.0 114.225 174.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 171.05 -147.8 10.7 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 125.893 1.711 . . . . 0.0 111.758 -178.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 47.0 p-10 -132.86 22.88 4.22 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.32 1.448 . . . . 0.0 112.889 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 20.5 p -76.27 -62.77 1.5 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.561 1.145 . . . . 0.0 113.526 -171.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 24.3 m 41.13 39.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 C-N-CA 125.835 1.654 . . . . 0.0 113.539 -172.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.51 -21.03 61.97 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 128.52 2.728 . . . . 0.0 116.264 -169.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 63.51 71.71 0.49 Allowed 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.36 1.464 . . . . 0.0 108.762 -167.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 43.1 p30 -76.7 176.38 8.48 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.997 1.319 . . . . 0.0 113.12 -170.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.29 -25.07 66.68 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.794 -1.191 . . . . 0.0 112.96 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.9 m -66.87 -42.52 85.49 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.274 -0.892 . . . . 0.0 110.909 170.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -64.03 -46.34 84.85 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.973 1.26 . . . . 0.0 111.288 173.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 95.9 mt -57.17 -27.13 61.64 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.756 0.707 . . . . 0.0 112.624 174.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 82.4 m -81.08 -37.84 28.31 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.492 1.117 . . . . 0.0 111.783 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -84.47 -29.95 25.64 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.895 1.442 . . . . 0.0 114.895 -175.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -54.15 -44.51 98.6 Favored Pre-proline 0 CA--C 1.552 1.033 0 CA-C-N 120.489 1.495 . . . . 0.0 112.111 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.27 -35.64 18.34 Favored 'Trans proline' 0 C--N 1.353 0.781 0 CA-C-N 122.205 1.823 . . . . 0.0 113.718 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -62.76 -38.66 91.45 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.453 1.479 . . . . 0.0 112.869 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 28.8 m -69.09 -29.19 42.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 62.5 mt -69.41 -52.15 35.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 124.08 0.952 . . . . 0.0 109.9 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -58.19 -42.83 86.97 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.814 0.846 . . . . 0.0 112.386 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -68.32 -27.64 66.46 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.809 0.844 . . . . 0.0 112.454 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.46 -48.92 15.93 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 121.364 -0.835 . . . . 0.0 112.906 176.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -24.93 66.06 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -75.42 -23.36 56.99 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.981 1.474 . . . . 0.0 114.981 170.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -138.6 71.95 43.59 Favored Pre-proline 0 CA--C 1.554 1.106 0 C-N-CA 124.603 1.161 . . . . 0.0 111.997 172.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -59.14 -16.96 36.14 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.615 2.877 . . . . 0.0 116.772 -172.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -78.33 -16.98 57.16 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.596 1.158 . . . . 0.0 113.32 -176.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -71.91 164.96 25.14 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.017 1.327 . . . . 0.0 111.717 -174.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -80.7 159.18 25.34 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.663 -0.648 . . . . 0.0 110.366 172.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 54.1 tp -73.58 -64.82 0.91 Allowed 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.775 -0.578 . . . . 0.0 112.395 173.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.43 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 2.7 m-85 -62.49 -21.3 65.38 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 116.441 2.015 . . . . 0.0 116.441 -167.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 13.8 t -55.87 -26.17 45.75 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.477 -0.764 . . . . 0.0 112.31 171.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -64.71 -2.29 2.39 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 119.823 -1.798 . . . . 0.0 113.748 173.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -72.28 -34.74 68.42 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 119.668 1.122 . . . . 0.0 111.839 165.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.52 -32.95 73.01 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -167.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' B' ' 151' ' ' GLN . 8.1 pt20 -73.55 -28.02 61.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 127.127 2.171 . . . . 0.0 115.706 175.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -111.48 100.37 8.95 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -165.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 44.2 p -96.32 45.39 1.07 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.06 1.744 . . . . 0.0 114.591 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 48.8 t30 -68.26 120.07 13.82 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.594 -1.316 . . . . 0.0 112.933 -176.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.7 t70 58.18 -64.41 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 129.161 2.984 . . . . 0.0 116.814 176.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.18 153.27 94.41 Favored Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.941 1.296 . . . . 0.0 112.277 177.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -67.99 142.76 57.72 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.449 2.099 . . . . 0.0 111.523 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 56.6 t30 . . . . . 0 C--O 1.253 1.289 0 C-N-CA 126.306 1.842 . . . . 0.0 113.08 -173.535 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.924 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.382 13.5 t-20 75.91 51.8 0.06 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 127.345 2.258 . . . . 0.0 112.759 -174.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.1 pm0 -64.33 -161.35 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.828 1 C-N-CA 132.942 4.497 . . . . 0.0 112.037 166.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.502 ' H ' ' HG3' ' B' ' 98' ' ' LYS . 26.8 t -148.4 88.5 1.64 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 113.853 -1.522 . . . . 0.0 109.335 167.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' B' ' 98' ' ' LYS . . . -57.69 -31.74 66.67 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 120.653 -1.279 . . . . 0.0 110.74 171.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 8.9 mttt -50.12 -49.55 51.44 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.602 1.961 . . . . 0.0 111.728 170.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -100.71 16.43 24.97 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.287 1.435 . . . . 0.0 113.842 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -55.83 124.13 16.52 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 167.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.5 t -75.48 153.12 37.73 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 120.9 -1.125 . . . . 0.0 110.141 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.2 m -62.23 -32.7 73.41 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.063 -1.648 . . . . 0.0 112.935 -175.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.0 tp60 -64.93 -31.0 72.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.91 0.884 . . . . 0.0 112.606 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -77.96 -37.7 46.88 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.193 1.397 . . . . 0.0 111.556 174.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.98 -49.41 77.77 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.455 -0.778 . . . . 0.0 112.885 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 9.3 pt -68.42 -5.79 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.669 1.188 . . . . 0.0 113.152 175.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -110.6 -8.45 14.61 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 125.811 1.644 . . . . 0.0 113.74 176.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.92 159.54 32.65 Favored 'General case' 0 CA--C 1.551 0.985 0 O-C-N 121.057 -1.027 . . . . 0.0 110.329 175.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -65.43 128.65 93.98 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 121.19 -0.944 . . . . 0.0 111.837 -173.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.62 -15.56 12.66 Favored 'Trans proline' 0 CA--C 1.546 1.123 0 C-N-CA 123.777 2.985 . . . . 0.0 115.567 178.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -62.5 -72.41 0.13 Allowed 'General case' 0 C--N 1.349 0.557 0 C-N-CA 126.423 1.889 . . . . 0.0 109.463 166.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -77.51 -4.11 43.95 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.745 1.387 . . . . 0.0 114.745 -177.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.9 ttt -58.18 -39.95 80.22 Favored 'General case' 0 C--O 1.222 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 112.92 170.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.263 20.1 m -66.21 -51.39 44.85 Favored Pre-proline 0 N--CA 1.48 1.063 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -174.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -50.16 -45.12 34.92 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 123.453 2.768 . . . . 0.0 115.841 169.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 p -73.69 -39.0 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 119.204 0.911 . . . . 0.0 113.358 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.72 -26.3 68.61 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.197 0.999 . . . . 0.0 111.676 172.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 65.5 t90 -83.61 -51.78 7.01 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-O 117.872 -1.061 . . . . 0.0 112.378 171.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.453 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.9 t90 -66.02 -34.85 79.03 Favored 'General case' 0 C--N 1.348 0.521 0 CA-C-N 120.329 1.422 . . . . 0.0 112.026 -167.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.3 tmm? -55.85 -38.82 70.58 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.694 1.198 . . . . 0.0 112.168 171.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.65 -36.95 68.1 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.257 1.423 . . . . 0.0 112.853 -169.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -91.47 -32.07 15.73 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.044 0.937 . . . . 0.0 113.038 169.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.8 tt0 73.1 153.97 0.14 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 129.013 2.925 . . . . 0.0 114.036 -169.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.17 11.48 0.22 Allowed 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.2 t -64.09 -9.81 18.65 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 127.295 2.238 . . . . 0.0 114.151 174.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.446 ' O ' ' HE3' ' A' ' 36' ' ' LYS 0.278 0.4 OUTLIER 76.61 160.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 127.856 2.463 . . . . 0.0 115.191 -177.459 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -86.94 95.22 9.83 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.266 1.826 . . . . 0.0 109.739 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.446 ' HE3' ' O ' ' A' ' 34' ' ' VAL . 14.7 mmtp -58.24 134.5 56.59 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.594 0.711 . . . . 0.0 112.785 -169.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.79 -6.36 3.74 Favored Glycine 0 CA--C 1.543 1.836 0 C-N-CA 125.828 1.68 . . . . 0.0 116.093 -176.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.09 155.1 5.54 Favored Glycine 0 CA--C 1.537 1.467 0 CA-C-N 119.308 1.554 . . . . 0.0 113.424 -172.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -159.41 -176.04 5.56 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.839 1.656 . . . . 0.0 108.092 -175.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 9.9 t -62.64 -31.86 72.79 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.843 -1.161 . . . . 0.0 109.564 164.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t 60.62 70.33 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 126.467 1.907 . . . . 0.0 112.557 -179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.5 p -118.33 154.19 32.75 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.541 1.136 . . . . 0.0 113.103 -177.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -72.13 82.57 0.99 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 122.586 1.184 . . . . 0.0 110.157 169.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -65.26 164.06 14.13 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.835 2.054 . . . . 0.0 111.739 174.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -67.44 -24.35 65.62 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.931 -1.105 . . . . 0.0 113.646 -171.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 55.2 m -61.92 -48.77 78.96 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 119.317 0.962 . . . . 0.0 110.676 169.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -57.81 -49.5 76.43 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 119.253 0.933 . . . . 0.0 110.385 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.33 -29.29 68.79 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.591 0.756 . . . . 0.0 112.259 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 94.7 m -78.74 -34.05 46.1 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.871 1.268 . . . . 0.0 111.857 174.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -79.14 -26.56 42.81 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 117.466 -1.254 . . . . 0.0 113.139 178.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mm -53.74 -46.13 98.49 Favored Pre-proline 0 N--CA 1.479 0.976 0 CA-C-N 120.327 1.421 . . . . 0.0 112.76 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.22 -37.24 14.57 Favored 'Trans proline' 0 C--N 1.352 0.731 0 CA-C-N 121.701 1.643 . . . . 0.0 113.141 172.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -65.88 -37.3 85.76 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.829 -1.169 . . . . 0.0 113.364 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.72 -16.96 20.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 123.221 0.608 . . . . 0.0 112.582 176.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 26.6 mt -85.12 -49.69 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 124.238 1.015 . . . . 0.0 110.232 171.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -57.47 -39.62 76.76 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 123.949 0.9 . . . . 0.0 111.758 176.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -71.38 -23.63 61.93 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.19 -0.943 . . . . 0.0 111.67 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -81.09 -44.2 18.34 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 121.051 -1.031 . . . . 0.0 112.151 175.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.4 -27.4 69.28 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 120.549 1.522 . . . . 0.0 113.698 172.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -71.76 -35.79 70.19 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -126.98 62.2 50.77 Favored Pre-proline 0 CA--C 1.546 0.809 0 C-N-CA 124.876 1.27 . . . . 0.0 111.376 -176.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -53.96 -17.15 10.28 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.707 3.605 . . . . 0.0 116.071 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -83.28 -22.9 32.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.589 1.555 . . . . 0.0 113.183 -176.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -68.53 159.24 32.2 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.077 0.951 . . . . 0.0 112.473 -169.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -97.54 118.15 33.41 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 -175.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.6 tp -43.24 -43.88 5.01 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 117.027 2.232 . . . . 0.0 117.027 -165.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.443 ' CG ' ' HA ' ' A' ' 6' ' ' LYS 0.251 4.3 m-30 -72.01 -8.23 53.36 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 120.445 1.475 . . . . 0.0 114.06 -177.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.2 p -58.74 -27.48 64.98 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 120.255 -1.528 . . . . 0.0 111.838 167.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -70.54 -11.67 61.08 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.581 -1.324 . . . . 0.0 112.664 177.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.0 tptm -68.8 -30.68 69.3 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.516 1.127 . . . . 0.0 112.057 169.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -69.41 -16.67 63.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.913 1.285 . . . . 0.0 112.003 -174.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -79.79 -26.37 40.62 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.266 2.226 . . . . 0.0 114.396 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -104.03 -98.16 0.31 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -163.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.1 m 53.2 59.37 4.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 125.48 1.512 . . . . 0.0 111.974 -168.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -59.71 -71.3 0.13 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.129 1.372 . . . . 0.0 114.332 -169.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -98.55 -57.42 2.2 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.565 ' CD1' ' H ' ' A' ' 77' ' ' LEU . 0.0 OUTLIER -79.07 146.57 67.93 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.147 1.779 . . . . 0.0 113.356 -176.42 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -82.9 171.72 11.53 Favored 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 124.182 3.255 . . . . 0.0 112.153 170.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.287 0 C-N-CA 125.499 1.52 . . . . 0.0 111.931 175.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.904 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 52.4 t30 58.05 48.28 13.4 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.98 1.712 . . . . 0.0 114.966 175.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -64.27 -20.54 66.13 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.117 167.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t 102.79 89.93 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 129.525 3.13 . . . . 0.0 116.975 166.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.7 -39.73 68.47 Favored 'General case' 0 CA--C 1.55 0.953 0 O-C-N 120.391 -1.443 . . . . 0.0 111.287 172.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.424 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 4.4 ptpt -77.08 1.65 17.45 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 116.374 1.99 . . . . 0.0 116.374 177.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -127.08 6.84 6.53 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.084 1.354 . . . . 0.0 112.64 169.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 33.4 ttm -62.2 137.43 58.25 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.778 -1.201 . . . . 0.0 110.046 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 22.2 p -74.18 167.51 21.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 122.124 0.964 . . . . 0.0 111.727 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.7 m -70.73 -36.28 73.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.826 170.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -63.12 -36.96 85.35 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.161 0.891 . . . . 0.0 112.58 172.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -75.86 -38.72 57.66 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.941 0.896 . . . . 0.0 111.874 175.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -59.94 -45.38 92.81 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.189 -0.944 . . . . 0.0 113.08 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -71.45 -0.1 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 118.89 0.768 . . . . 0.0 112.665 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -119.03 -14.77 9.33 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 126.331 1.853 . . . . 0.0 114.949 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 pp -61.64 159.15 13.8 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.956 1.253 . . . . 0.0 111.234 173.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -73.31 130.7 83.96 Favored Pre-proline 0 N--CA 1.482 1.151 0 O-C-N 120.72 -1.238 . . . . 0.0 110.263 -178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -58.18 -26.93 78.35 Favored 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 121.69 1.593 . . . . 0.0 114.445 -169.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.502 ' HG3' ' H ' ' A' ' 4' ' ' SER . 6.5 mptt -56.7 -15.07 3.88 Favored 'General case' 0 C--O 1.21 -1.022 0 CA-C-N 121.459 1.936 . . . . 0.0 114.604 175.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -123.38 21.37 9.51 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-N 122.791 2.541 . . . . 0.0 114.61 167.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 35.7 ttm -73.42 -57.84 3.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.44 1.496 . . . . 0.0 112.503 172.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 57.6 m -49.58 -52.35 51.11 Favored Pre-proline 0 N--CA 1.488 1.47 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.35 -45.26 40.74 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.996 3.13 . . . . 0.0 115.792 172.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.2 p -75.63 -39.84 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 120.749 1.613 . . . . 0.0 112.785 177.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.82 -31.58 69.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.776 0.83 . . . . 0.0 111.252 174.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.469 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 37.5 t90 -83.06 -47.18 11.95 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 117.556 -1.211 . . . . 0.0 112.102 171.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.413 ' CZ2' ' CD2' ' A' ' 26' ' ' TRP . 2.6 t90 -68.84 -24.1 64.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 121.208 1.822 . . . . 0.0 111.128 -170.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -65.09 -46.91 79.14 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.935 1.294 . . . . 0.0 111.51 169.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.33 -24.77 68.0 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.173 1.389 . . . . 0.0 113.187 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -119.31 54.03 1.0 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.091 2.156 . . . . 0.0 111.773 172.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -48.34 128.42 14.43 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.547 1.314 . . . . 0.0 114.547 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 57.72 10.13 1.0 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.464 1.506 . . . . 0.0 114.536 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 53.67 -13.57 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 119.484 3.142 . . . . 0.0 119.484 -178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.78 135.08 24.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 119.423 1.011 . . . . 0.0 111.976 -170.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.19 162.54 28.66 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -166.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -149.81 139.17 21.4 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.683 1.593 . . . . 0.0 111.503 -173.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 63.01 14.22 51.96 Favored Glycine 0 CA--C 1.542 1.731 0 N-CA-C 116.765 1.466 . . . . 0.0 116.765 171.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 173.19 -163.85 35.55 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.92 1.36 . . . . 0.0 113.952 -174.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -135.92 11.61 3.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.441 1.496 . . . . 0.0 114.863 -171.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 35.4 p -74.8 31.71 0.09 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 -169.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 27.6 m -64.43 -8.18 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 O-C-N 120.954 -1.091 . . . . 0.0 112.778 168.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.12 147.83 2.01 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 127.469 2.308 . . . . 0.0 113.288 173.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 39.7 tp -74.27 70.2 1.63 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.456 1.102 . . . . 0.0 110.028 169.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 18.8 p30 -72.34 174.0 7.94 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 127.042 2.137 . . . . 0.0 112.335 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.38 -27.16 65.99 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -172.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 18.6 m -65.31 -50.98 63.62 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.246 0.93 . . . . 0.0 109.739 169.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -59.46 -48.87 80.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.311 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 76.0 mt -52.82 -34.91 56.03 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.264 1.025 . . . . 0.0 113.009 174.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 58.7 m -75.72 -33.15 60.29 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.375 0.67 . . . . 0.0 111.596 175.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -81.03 -25.1 37.43 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 179.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 5.1 mm -54.42 -44.35 98.75 Favored Pre-proline 0 CA--C 1.555 1.161 0 CA-C-N 120.187 1.358 . . . . 0.0 112.173 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.98 -34.38 10.59 Favored 'Trans proline' 0 C--N 1.355 0.873 0 CA-C-N 121.821 1.686 . . . . 0.0 113.204 171.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -66.1 -32.39 73.82 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 120.659 -1.276 . . . . 0.0 113.604 -177.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.09 -25.9 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 118.663 0.665 . . . . 0.0 112.481 173.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.5 mt -73.62 -53.06 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.797 0.839 . . . . 0.0 109.546 171.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -57.42 -44.21 84.46 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.935 0.894 . . . . 0.0 112.184 178.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -71.44 -24.48 62.03 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.99 -1.069 . . . . 0.0 112.172 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.1 m -77.88 -46.01 22.57 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 121.118 -0.989 . . . . 0.0 112.055 177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -26.03 68.59 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 120.28 1.4 . . . . 0.0 113.778 174.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -72.85 -32.34 65.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 168.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -129.34 60.51 51.62 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 125.22 1.408 . . . . 0.0 111.11 -175.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -60.17 -17.07 43.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 123.747 2.965 . . . . 0.0 115.424 -169.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -80.39 -18.01 50.18 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.668 1.187 . . . . 0.0 113.355 -178.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -71.79 165.97 22.99 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.252 1.021 . . . . 0.0 112.429 -172.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -92.49 130.82 38.05 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 170.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 55.0 tp -46.71 -34.51 5.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.271 1.828 . . . . 0.0 114.092 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.424 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 5.2 m-85 -84.66 -8.71 58.77 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 71.6 p -62.81 -25.59 68.32 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 120.564 -1.335 . . . . 0.0 111.391 168.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -71.5 -2.98 18.7 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.28 1.432 . . . . 0.0 114.204 179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -32.17 41.35 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.942 1.297 . . . . 0.0 111.277 167.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -72.44 -31.04 65.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.639 1.176 . . . . 0.0 112.431 -169.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -67.82 -30.0 69.3 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.701 1.6 . . . . 0.0 114.662 171.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -98.67 -38.55 9.07 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -167.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 49.9 m 61.42 -37.03 0.11 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 127.487 2.315 . . . . 0.0 116.263 -169.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 65.36 -174.17 0.18 Allowed 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 128.482 2.713 . . . . 0.0 114.911 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -61.43 -34.38 75.3 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 116.465 2.024 . . . . 0.0 116.465 -167.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.0 159.47 84.0 Favored Pre-proline 0 CA--C 1.553 1.059 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -63.51 127.34 19.62 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 122.719 2.28 . . . . 0.0 110.478 168.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.201 0 C-N-CA 125.276 1.431 . . . . 0.0 111.878 -169.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 51.3 t30 57.14 46.14 19.5 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.109 1.764 . . . . 0.0 115.118 177.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -61.97 -22.9 66.04 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.411 167.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t 93.42 98.85 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 128.571 2.748 . . . . 0.0 117.217 165.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.27 -30.33 66.5 Favored 'General case' 0 CA--C 1.556 1.19 0 O-C-N 120.211 -1.556 . . . . 0.0 112.06 172.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.448 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 11.1 mtmt -64.91 -20.51 66.48 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 125.821 1.649 . . . . 0.0 114.869 173.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -114.5 7.36 16.17 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.035 1.334 . . . . 0.0 113.053 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.1 ttm -63.12 123.93 19.85 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 120.68 -1.263 . . . . 0.0 109.771 172.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.62 155.35 29.62 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 121.156 -0.965 . . . . 0.0 110.379 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -63.5 -33.46 75.64 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 120.247 -1.533 . . . . 0.0 113.291 -174.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -62.13 -32.99 73.64 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 171.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -78.93 -36.42 41.8 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.123 1.369 . . . . 0.0 111.774 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.09 -49.31 78.17 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.402 -0.811 . . . . 0.0 112.502 177.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 6.2 pt -68.51 -2.54 2.03 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 C-N-CA 124.743 1.217 . . . . 0.0 112.856 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -113.49 -11.1 13.12 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.872 1.669 . . . . 0.0 113.826 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.23 155.64 38.32 Favored 'General case' 0 CA--C 1.551 0.994 0 O-C-N 121.116 -0.99 . . . . 0.0 110.726 172.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -68.36 132.82 91.35 Favored Pre-proline 0 N--CA 1.48 1.043 0 O-C-N 121.052 -1.03 . . . . 0.0 111.231 -176.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -45.49 -35.42 12.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.304 3.336 . . . . 0.0 114.466 175.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.46 ' HG2' ' H ' ' B' ' 83' ' ' SER . 38.7 mttt -61.2 -19.06 61.17 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 115.565 1.691 . . . . 0.0 115.565 -177.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -127.52 19.53 6.78 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 120.655 1.57 . . . . 0.0 114.207 166.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 47.6 mtp -65.79 -58.73 4.95 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.784 0.833 . . . . 0.0 111.961 168.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 m -40.96 -55.31 4.86 Favored Pre-proline 0 N--CA 1.494 1.755 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -58.04 -39.43 85.9 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 123.791 2.994 . . . . 0.0 115.806 175.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.8 -38.4 44.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 CA-C-N 119.807 1.185 . . . . 0.0 112.632 174.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.96 -21.35 66.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.303 1.041 . . . . 0.0 111.573 175.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.452 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 70.9 t90 -92.36 -49.12 6.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 116.986 -1.483 . . . . 0.0 112.973 168.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -69.27 -22.87 63.79 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 121.744 2.065 . . . . 0.0 112.512 -169.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 18.0 tmm? -70.76 -34.42 71.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.327 -0.858 . . . . 0.0 111.592 169.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.87 -42.58 32.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.953 1.701 . . . . 0.0 111.99 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 -119.27 107.51 13.5 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.967 1.307 . . . . 0.0 107.935 166.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -65.16 174.37 2.05 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-O 121.056 0.455 . . . . 0.0 111.978 176.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.96 13.4 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 174.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.6 t -59.53 136.46 57.99 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.447 1.499 . . . . 0.0 111.944 -177.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.5 t -71.64 129.64 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -72.05 157.85 37.03 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -167.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -142.9 143.67 32.13 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.836 1.654 . . . . 0.0 111.852 -169.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.48 31.54 Favored Glycine 0 CA--C 1.544 1.905 0 C-N-CA 124.586 1.088 . . . . 0.0 115.466 -177.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 154.78 -160.75 29.86 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 126.797 2.141 . . . . 0.0 111.01 -172.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -134.31 16.78 3.73 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 114.389 1.255 . . . . 0.0 114.389 -169.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.0 p -76.54 41.93 0.27 Allowed 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -169.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -21.55 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 125.0 1.32 . . . . 0.0 112.658 173.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -39.04 141.34 0.31 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.423 2.689 . . . . 0.0 113.695 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 35.1 tp -63.02 99.74 0.18 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 168.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -108.78 173.35 6.36 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.371 1.468 . . . . 0.0 112.023 -169.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.38 -26.88 68.2 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.221 -1.549 . . . . 0.0 113.565 -169.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 95.3 m -62.49 -43.18 99.44 Favored 'General case' 0 N--CA 1.476 0.871 0 O-C-N 121.362 -0.836 . . . . 0.0 110.262 168.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.25 -40.58 90.27 Favored 'General case' 0 C--O 1.221 -0.418 0 O-C-N 121.286 -0.884 . . . . 0.0 110.97 176.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 82.6 mt -65.76 -23.03 66.63 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.376 0.989 . . . . 0.0 111.433 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.0 m -79.43 -37.3 37.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 124.055 0.942 . . . . 0.0 111.529 169.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.6 mm100 -85.96 -27.06 25.14 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -175.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.26 -42.07 89.46 Favored Pre-proline 0 CA--C 1.551 1.009 0 CA-C-N 120.455 1.48 . . . . 0.0 112.385 175.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -70.58 -37.79 6.79 Favored 'Trans proline' 0 C--N 1.355 0.911 0 CA-C-N 121.97 1.739 . . . . 0.0 113.186 169.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 51.7 mmtt -66.81 -32.67 74.1 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 120.225 -1.547 . . . . 0.0 113.839 -176.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.7 m -69.07 -20.94 25.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 119.011 0.823 . . . . 0.0 112.949 173.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 19.0 mt -83.95 -51.04 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.043 0.937 . . . . 0.0 110.023 171.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.45 -38.84 78.34 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.152 0.981 . . . . 0.0 111.969 178.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -68.94 -30.28 68.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.556 0.616 . . . . 0.0 111.305 177.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.1 m -76.62 -42.51 42.02 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 120.934 -1.104 . . . . 0.0 113.072 176.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.71 -29.62 68.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 120.877 1.671 . . . . 0.0 113.914 177.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.425 ' HG3' HD22 ' A' ' 61' ' ' ASN . 14.3 ptpt -80.11 -29.19 38.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 174.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.425 HD22 ' HG3' ' A' ' 60' ' ' LYS . 24.3 m-80 -129.81 70.74 82.13 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 125.521 1.528 . . . . 0.0 111.121 174.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -59.53 -11.74 15.02 Favored 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.859 3.706 . . . . 0.0 116.254 -177.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -83.69 -21.48 32.37 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.355 1.462 . . . . 0.0 113.146 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -69.1 157.4 36.91 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.113 0.965 . . . . 0.0 111.49 -174.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -94.39 134.54 36.78 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 176.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.8 tp -51.85 -38.85 57.54 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -168.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.448 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 5.2 m-85 -79.6 -5.88 55.92 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.7 p -61.41 -27.58 68.64 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 120.043 -1.661 . . . . 0.0 110.948 167.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -73.41 -2.91 24.28 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.417 1.487 . . . . 0.0 113.487 177.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -31.48 37.53 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.548 1.539 . . . . 0.0 111.714 168.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -70.22 -26.66 63.97 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.742 1.217 . . . . 0.0 112.198 -171.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -79.34 -31.16 42.98 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.763 1.625 . . . . 0.0 115.056 175.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -110.79 93.55 4.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.614 1.165 . . . . 0.0 113.602 -167.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.2 m -88.99 39.87 0.95 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.212 1.405 . . . . 0.0 114.768 -171.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -80.67 4.66 18.0 Favored 'General case' 0 CA--C 1.552 1.019 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -169.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -72.59 18.38 0.1 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 116.255 1.946 . . . . 0.0 116.255 -168.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -163.32 153.27 13.15 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 126.057 1.743 . . . . 0.0 112.03 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -66.8 157.57 60.58 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 122.096 1.864 . . . . 0.0 110.508 165.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.314 0 C-N-CA 125.369 1.468 . . . . 0.0 112.835 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.837 0 N-CA-C 111.762 0.282 . . . . 0.0 111.762 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -163.05 118.7 1.77 Allowed 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 122.707 1.241 . . . . 0.0 108.275 168.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.73 -163.22 0.94 Allowed 'General case' 0 N--CA 1.427 -1.616 0 C-N-CA 129.208 3.003 . . . . 0.0 107.719 -166.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 19' ' ' LYS . 20.2 m -137.03 56.53 1.79 Allowed 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 124.032 0.933 . . . . 0.0 109.26 168.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.68 -39.79 68.45 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 120.546 -1.347 . . . . 0.0 109.677 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.452 ' HA ' ' CG ' ' B' ' 146' ' ' TYR . 2.4 ptpt -68.18 -6.31 22.69 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.449 2.699 . . . . 0.0 116.527 175.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -138.42 18.4 2.74 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.495 1.518 . . . . 0.0 112.143 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . 0.428 ' HE1' HD22 ' B' ' 95' ' ' LEU . 23.4 ttm -60.09 123.76 18.13 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-N 120.023 1.283 . . . . 0.0 108.143 177.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 13.8 t -76.6 152.15 36.0 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.065 -175.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.9 m -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.195 -1.566 . . . . 0.0 112.763 -170.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -32.42 71.92 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 119.34 0.973 . . . . 0.0 112.38 173.5 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -74.41 -37.3 63.41 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.538 1.535 . . . . 0.0 111.231 174.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -64.01 -49.75 71.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.652 1.181 . . . . 0.0 113.203 175.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 4.0 pt -68.66 -3.88 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 176.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -103.78 -10.13 18.51 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 126.073 1.749 . . . . 0.0 114.053 169.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . 0.428 HD22 ' HE1' ' B' ' 87' ' ' MET . 0.2 OUTLIER -70.77 160.76 32.11 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.702 -1.249 . . . . 0.0 110.464 171.006 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.448 HD21 ' HD2' ' B' ' 98' ' ' LYS . 53.8 t-20 -69.44 130.47 90.75 Favored Pre-proline 0 N--CA 1.481 1.122 0 O-C-N 121.376 -0.827 . . . . 0.0 111.942 -178.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -57.13 -19.95 35.79 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 C-N-CA 123.57 2.847 . . . . 0.0 115.614 176.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.448 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.8 mttt -55.81 -66.19 0.47 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 126.487 1.915 . . . . 0.0 110.386 168.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.37 -6.57 59.4 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 18.6 ttm -58.37 -38.02 76.42 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.97 -1.081 . . . . 0.0 111.313 168.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 63.3 m -60.48 -56.75 32.21 Favored Pre-proline 0 CA--C 1.552 1.057 0 C-N-CA 124.346 1.058 . . . . 0.0 112.598 -177.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -52.85 -44.61 46.95 Favored 'Trans proline' 0 C--N 1.357 1.001 0 C-N-CA 124.187 3.258 . . . . 0.0 115.408 171.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.21 -37.21 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 120.442 1.474 . . . . 0.0 112.896 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.79 -24.93 67.04 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.629 0.771 . . . . 0.0 110.975 175.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.505 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.4 t90 -83.14 -51.16 7.75 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.496 168.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.505 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.3 t90 -64.98 -33.55 76.31 Favored 'General case' 0 C--N 1.349 0.569 0 CA-C-N 120.673 1.579 . . . . 0.0 111.278 -168.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.6 tmm? -57.17 -44.24 83.34 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.734 1.214 . . . . 0.0 112.352 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.73 -33.33 75.62 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.294 1.438 . . . . 0.0 111.909 -173.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -98.68 -10.44 23.22 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 173.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 46.83 -72.01 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 130.141 3.377 . . . . 0.0 116.22 -168.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -66.79 137.25 56.49 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.783 0.801 . . . . 0.0 111.729 -167.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 10.6 p -66.87 -2.32 5.03 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -178.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.3 p -134.93 148.04 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 126.084 1.754 . . . . 0.0 110.96 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -79.84 159.97 26.27 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.41 1.084 . . . . 0.0 113.123 -177.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.21 152.8 41.35 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.151 1.381 . . . . 0.0 111.578 -168.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.32 -95.88 0.38 Allowed Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.141 0.877 . . . . 0.0 111.549 -177.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . -78.58 -163.28 23.33 Favored Glycine 0 CA--C 1.539 1.543 0 C-N-CA 124.519 1.057 . . . . 0.0 113.151 169.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -127.24 11.47 6.96 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.396 1.478 . . . . 0.0 114.214 -178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 3.9 m -78.25 61.39 2.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.338 1.455 . . . . 0.0 112.549 -172.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 7.0 t -59.02 -25.45 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.607 1.163 . . . . 0.0 111.695 175.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.86 138.34 19.02 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.658 1.183 . . . . 0.0 111.87 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 93.4 mt -67.05 126.23 28.52 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.523 -0.736 . . . . 0.0 110.871 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -95.15 166.71 11.78 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.025 1.33 . . . . 0.0 109.635 176.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.1 -30.16 71.37 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 120.72 -1.237 . . . . 0.0 112.432 -176.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 89.3 m -64.98 -41.72 95.19 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 121.421 -0.799 . . . . 0.0 111.863 169.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -63.52 -47.68 80.67 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 120.107 1.321 . . . . 0.0 110.174 177.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 89.8 mt -58.13 -30.5 66.38 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.251 1.02 . . . . 0.0 112.515 175.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 91.2 m -80.29 -37.19 33.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.587 1.155 . . . . 0.0 112.104 174.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -74.15 -31.88 62.9 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.519 -1.363 . . . . 0.0 113.602 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.59 -51.84 75.05 Favored Pre-proline 0 CA--C 1.55 0.979 0 CA-C-N 120.068 1.304 . . . . 0.0 112.208 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -66.64 -33.19 36.48 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 CA-C-N 121.922 1.722 . . . . 0.0 113.5 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -62.99 -41.43 99.57 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.625 1.557 . . . . 0.0 113.008 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 22.7 m -72.44 -28.35 28.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 O-C-N 121.832 -0.542 . . . . 0.0 112.427 176.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 54.6 mt -67.23 -47.49 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.302 0.501 . . . . 0.0 110.318 172.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -57.99 -44.31 87.08 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.857 0.863 . . . . 0.0 111.624 172.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -59.73 -23.45 63.2 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 120.942 -1.099 . . . . 0.0 113.173 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.34 -51.12 8.69 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.626 1.103 . . . . 0.0 112.434 175.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -26.65 68.51 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 120.614 1.552 . . . . 0.0 113.508 173.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -73.02 -29.79 63.27 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.467 1.507 . . . . 0.0 114.663 169.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -131.63 64.87 74.45 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 125.083 1.353 . . . . 0.0 110.659 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.51 -15.35 40.73 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.851 3.034 . . . . 0.0 116.483 -168.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -84.33 -12.84 53.86 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.561 1.144 . . . . 0.0 114.051 178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -77.48 163.54 26.24 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.726 1.21 . . . . 0.0 112.529 -170.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -79.18 143.89 34.97 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 121.837 -0.54 . . . . 0.0 109.813 169.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.78 -39.51 85.15 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.796 1.035 . . . . 0.0 113.796 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.452 ' CG ' ' HA ' ' B' ' 85' ' ' LYS . 3.0 m-30 -82.65 -26.7 31.92 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 -170.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 14.9 t -61.58 -19.18 61.9 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 120.903 -1.123 . . . . 0.0 112.187 173.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.68 -4.19 1.9 Allowed 'General case' 0 CA--C 1.538 0.518 0 O-C-N 119.554 -1.966 . . . . 0.0 113.957 171.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -33.68 71.58 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.554 1.07 . . . . 0.0 111.965 166.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.01 -32.42 73.78 Favored 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -167.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . 0.402 ' HG2' ' H ' ' B' ' 151' ' ' GLN . 8.3 pt20 -71.06 -28.2 64.19 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.744 2.018 . . . . 0.0 115.154 172.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -91.71 131.8 36.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -167.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 82.0 p -129.44 6.72 5.28 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.734 1.753 . . . . 0.0 115.734 -176.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -67.7 132.85 48.25 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -169.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 13.9 t70 59.37 -31.85 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 129.635 3.174 . . . . 0.0 117.708 172.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.1 pp -64.88 148.93 97.09 Favored Pre-proline 0 CA--C 1.552 1.027 0 C-N-CA 126.069 1.748 . . . . 0.0 112.104 173.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.17 155.25 52.08 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.304 2.669 . . . . 0.0 113.013 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.975 1.71 . . . . 0.0 111.834 177.56 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.759 0 CA-C-O 120.545 0.212 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -160.73 116.5 2.26 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 123.037 1.399 . . . . 0.0 108.379 168.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.553 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 0.5 OUTLIER -166.67 -176.93 3.7 Favored 'General case' 0 N--CA 1.422 -1.852 0 C-N-CA 130.048 3.339 . . . . 0.0 106.323 -165.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.429 ' H ' ' HG2' ' B' ' 98' ' ' LYS . 17.3 m -128.94 57.58 1.62 Allowed 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 123.402 0.681 . . . . 0.0 109.947 169.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.553 ' H ' ' HG2' ' A' ' 3' ' ' GLU . . . -53.35 -40.64 65.08 Favored 'General case' 0 N--CA 1.481 1.101 0 CA-C-N 120.166 1.348 . . . . 0.0 109.414 176.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.469 ' HA ' ' CD2' ' A' ' 67' ' ' TYR . 3.0 mppt? -45.39 -29.03 0.97 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 130.592 3.557 . . . . 0.0 114.893 169.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -134.77 21.99 3.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.963 1.705 . . . . 0.0 111.743 -178.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.526 ' HE1' HD22 ' A' ' 16' ' ' LEU . 20.4 ttm -60.05 120.02 8.91 Favored 'General case' 0 C--N 1.352 0.706 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 13.3 t -74.97 152.1 38.79 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 -173.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.35 -28.4 69.26 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 120.624 -1.297 . . . . 0.0 113.165 -170.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.41 90.94 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 118.886 0.766 . . . . 0.0 111.595 169.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -70.47 -37.14 74.22 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.257 1.023 . . . . 0.0 111.949 175.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -59.38 -52.29 66.27 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.349 -0.845 . . . . 0.0 112.812 174.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.2 pt -69.87 0.93 1.07 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 124.546 1.138 . . . . 0.0 112.627 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -112.61 -14.76 13.14 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.072 1.749 . . . . 0.0 114.02 173.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.526 HD22 ' HE1' ' A' ' 8' ' ' MET . 0.3 OUTLIER -67.03 162.72 21.51 Favored 'General case' 0 CA--C 1.552 1.049 0 O-C-N 120.88 -1.137 . . . . 0.0 110.127 169.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.519 HD21 ' HD3' ' A' ' 19' ' ' LYS . 50.4 t-20 -68.22 129.93 92.68 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 120.823 -1.173 . . . . 0.0 112.409 -175.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 38.8 Cg_exo -58.81 -12.31 14.45 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.269 3.312 . . . . 0.0 116.15 176.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.519 ' HD3' HD21 ' A' ' 17' ' ' ASN . 7.6 mttt -65.37 -63.06 1.19 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 126.334 1.854 . . . . 0.0 108.669 166.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.62 0.92 44.75 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.337 1.977 . . . . 0.0 116.337 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 72.8 mtp -59.54 -38.5 81.22 Favored 'General case' 0 N--CA 1.485 1.302 0 O-C-N 120.818 -1.176 . . . . 0.0 112.116 169.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 21.8 m -66.64 -51.53 39.97 Favored Pre-proline 0 N--CA 1.48 1.045 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 -173.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_endo -49.5 -46.75 25.32 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 123.66 2.907 . . . . 0.0 116.132 169.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.09 -39.65 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 O-C-N 120.954 -1.091 . . . . 0.0 112.765 178.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.12 -27.33 68.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.558 0.743 . . . . 0.0 111.803 173.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 81.1 t90 -83.43 -52.21 6.72 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 118.058 -0.972 . . . . 0.0 112.727 171.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.434 ' CZ2' ' CD2' ' B' ' 105' ' ' TRP . 2.4 t90 -66.05 -34.63 78.53 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 120.213 1.37 . . . . 0.0 111.517 -168.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -56.58 -42.83 79.33 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.988 1.315 . . . . 0.0 111.731 171.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -65.6 -18.99 65.73 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.679 1.592 . . . . 0.0 113.788 175.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -108.18 -7.66 15.96 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 57.87 13.74 2.24 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 125.752 1.621 . . . . 0.0 115.108 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 49.26 30.91 3.36 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.207 1.403 . . . . 0.0 112.269 -166.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.8 t -69.53 -9.61 54.62 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 114.772 1.397 . . . . 0.0 114.772 -171.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.257 0.4 OUTLIER 65.05 152.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 127.404 2.282 . . . . 0.0 113.487 -170.416 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -85.36 137.14 33.14 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.912 0.885 . . . . 0.0 111.93 -177.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -150.8 146.48 26.4 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.205 1.402 . . . . 0.0 111.25 -169.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.57 -77.6 0.26 Allowed Glycine 0 CA--C 1.536 1.384 0 C-N-CA 124.183 0.896 . . . . 0.0 111.343 -170.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.68 177.37 54.39 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 124.624 1.106 . . . . 0.0 112.35 168.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -143.14 16.89 1.91 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 42' ' ' THR . 7.3 p -65.74 -51.9 55.46 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -173.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.5 t 61.58 -20.93 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 125.658 1.583 . . . . 0.0 114.602 -169.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.447 ' H ' ' C ' ' A' ' 40' ' ' THR . 43.0 p -44.48 149.46 0.39 Allowed 'General case' 0 C--O 1.238 0.487 0 C-N-CA 128.314 2.646 . . . . 0.0 114.738 -175.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mt -70.86 73.47 0.58 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 122.733 1.254 . . . . 0.0 109.434 165.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -66.0 167.9 9.08 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.506 2.723 . . . . 0.0 112.117 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -68.13 -22.67 64.87 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.667 -1.271 . . . . 0.0 114.304 -172.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 21.9 m -65.55 -49.97 66.93 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.218 0.917 . . . . 0.0 110.141 169.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -55.99 -51.83 66.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 118.804 0.729 . . . . 0.0 110.779 173.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.7 mt -61.11 -30.63 70.47 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.41 0.684 . . . . 0.0 112.234 -175.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.1 m -73.78 -38.29 64.71 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.375 0.67 . . . . 0.0 111.39 173.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -82.07 -24.22 35.37 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 117.398 -1.287 . . . . 0.0 113.667 -175.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.2 mm -52.49 -48.66 89.28 Favored Pre-proline 0 N--CA 1.478 0.964 0 CA-C-N 120.504 1.502 . . . . 0.0 111.79 177.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.4 -37.59 22.9 Favored 'Trans proline' 0 C--N 1.353 0.787 0 CA-C-N 121.484 1.566 . . . . 0.0 113.342 172.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -66.05 -37.02 84.78 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.671 -1.268 . . . . 0.0 113.292 -175.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 31.4 m -68.14 -22.19 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 175.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 20.7 mt -81.09 -50.95 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 123.562 0.745 . . . . 0.0 110.116 172.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -59.54 -39.61 84.52 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.08 0.952 . . . . 0.0 112.008 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -66.75 -30.33 70.52 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 122.952 0.501 . . . . 0.0 111.373 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.68 -46.89 28.74 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 174.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.2 -29.97 68.94 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 121.094 1.77 . . . . 0.0 114.145 178.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.88 -34.52 60.0 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 175.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -132.04 78.08 70.1 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.506 1.123 . . . . 0.0 111.932 171.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -54.58 -12.57 4.49 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 124.844 3.696 . . . . 0.0 117.462 176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.32 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.229 1.412 . . . . 0.0 112.817 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -66.07 159.5 25.91 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 113.1 -171.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -84.13 138.84 32.81 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.636 -0.665 . . . . 0.0 109.389 169.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 58.5 tp -56.22 -34.33 66.21 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 172.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.469 ' CD2' ' HA ' ' A' ' 6' ' ' LYS . 2.8 m-85 -85.36 -29.66 24.28 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 115.558 1.688 . . . . 0.0 115.558 -173.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 7.7 t -64.28 -12.48 41.94 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.11 -0.994 . . . . 0.0 112.078 174.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -66.34 -3.69 6.46 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 119.662 -1.899 . . . . 0.0 113.737 169.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 -30.55 32.94 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.431 1.492 . . . . 0.0 111.955 167.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -66.68 -28.52 68.52 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.11 1.364 . . . . 0.0 112.074 -173.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -77.05 -30.01 55.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.504 1.521 . . . . 0.0 114.79 173.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -108.84 97.86 7.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 114.516 1.302 . . . . 0.0 114.516 -166.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -75.48 104.74 6.16 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 167.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -80.16 178.19 8.42 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.7 0.8 . . . . 0.0 112.211 -172.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -75.82 47.31 0.41 Allowed 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.515 1.926 . . . . 0.0 114.24 -173.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -150.02 159.1 36.16 Favored Pre-proline 0 CA--C 1.552 1.025 0 C-N-CA 127.275 2.23 . . . . 0.0 112.263 -178.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -69.83 159.63 52.67 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.058 2.505 . . . . 0.0 112.424 169.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 124.326 1.05 . . . . 0.0 112.071 173.186 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.959 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 50.3 t30 58.91 49.7 9.39 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.691 1.597 . . . . 0.0 114.294 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -61.56 -19.59 62.34 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.729 0.812 . . . . 0.0 112.968 168.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 11.6 t 103.98 97.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 129.552 3.141 . . . . 0.0 114.343 169.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.62 -33.7 71.84 Favored 'General case' 0 CA--C 1.554 1.099 0 O-C-N 120.522 -1.361 . . . . 0.0 110.711 169.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -41.25 74.95 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 127.104 2.162 . . . . 0.0 113.454 173.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -102.77 8.16 39.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.066 1.347 . . . . 0.0 113.297 -174.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.0 ttm -62.59 123.08 17.43 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 109.904 172.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.3 t -77.78 155.34 31.2 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.041 -1.037 . . . . 0.0 110.494 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.84 -32.84 74.14 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.274 -1.516 . . . . 0.0 112.984 -174.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.85 -31.65 72.9 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 118.871 0.76 . . . . 0.0 112.871 172.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -80.18 -36.63 34.71 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.306 1.443 . . . . 0.0 111.357 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -61.45 -48.55 80.64 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.784 0.834 . . . . 0.0 112.611 175.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.7 pt -69.45 -1.43 1.75 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 C-N-CA 123.73 0.812 . . . . 0.0 113.163 176.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -110.56 -9.29 14.56 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 126.38 1.872 . . . . 0.0 114.076 172.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.71 155.72 40.08 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 119.875 1.216 . . . . 0.0 110.702 174.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -67.75 130.84 92.84 Favored Pre-proline 0 N--CA 1.479 0.982 0 O-C-N 121.292 -0.88 . . . . 0.0 110.624 -179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -46.58 -35.06 16.16 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.193 3.262 . . . . 0.0 114.117 175.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.429 ' HG2' ' H ' ' A' ' 4' ' ' SER . 59.3 mttt -60.39 -14.8 20.85 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -132.92 19.01 4.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.891 1.678 . . . . 0.0 112.609 166.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 29.1 ttm -70.0 -52.01 27.68 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.802 1.241 . . . . 0.0 110.88 169.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 2.7 m -45.76 -56.62 9.63 Favored Pre-proline 0 N--CA 1.489 1.519 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 176.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.88 -43.29 58.49 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.052 3.168 . . . . 0.0 115.389 175.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 9.3 p -74.39 -38.3 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 120.184 1.356 . . . . 0.0 112.724 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.04 -26.99 68.58 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.99 0.916 . . . . 0.0 111.042 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.507 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 60.7 t90 -84.01 -52.87 5.97 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 117.75 -1.119 . . . . 0.0 112.294 168.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.507 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.8 t90 -64.33 -31.18 72.28 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 120.048 1.295 . . . . 0.0 112.683 -166.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 18.9 tmm? -61.61 -49.31 77.1 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.592 1.157 . . . . 0.0 111.406 172.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.73 -28.63 65.96 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.492 1.517 . . . . 0.0 111.802 -177.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -153.34 94.58 1.83 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.91 1.684 . . . . 0.0 109.635 -171.011 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -71.41 166.73 21.07 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.178 1.547 . . . . 0.0 115.178 -171.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . 0.404 ' HB3' ' HE1' ' B' ' 106' ' ' TRP . 0.0 OUTLIER -69.38 18.68 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.284 0 O-C-N 120.689 -1.257 . . . . 0.0 114.347 168.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 14.5 t -58.66 149.25 26.5 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 124.987 1.315 . . . . 0.0 112.207 -178.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 65.0 t -65.34 120.57 12.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 C-N-CA 123.921 0.888 . . . . 0.0 109.232 -176.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.94 160.02 21.16 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 116.029 1.863 . . . . 0.0 116.029 -166.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -152.57 149.37 28.42 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.658 1.583 . . . . 0.0 112.231 -170.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.09 3.63 31.27 Favored Glycine 0 CA--C 1.539 1.568 0 N-CA-C 117.167 1.627 . . . . 0.0 117.167 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 169.82 -160.26 33.23 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 118.893 1.346 . . . . 0.0 113.307 -176.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -130.4 17.25 5.42 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.828 1.651 . . . . 0.0 114.065 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 12.0 p -72.81 37.18 0.08 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 127.066 2.146 . . . . 0.0 115.726 -170.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 26.7 m -78.93 -12.89 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 O-C-N 120.514 -1.366 . . . . 0.0 113.947 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.98 168.41 11.9 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.403 1.481 . . . . 0.0 110.901 167.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 40.0 mt -63.18 115.97 4.99 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.986 -1.071 . . . . 0.0 110.625 168.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -92.54 173.27 7.87 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.065 1.346 . . . . 0.0 111.193 175.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -58.04 -36.61 73.0 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.431 -0.793 . . . . 0.0 112.385 177.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 42.4 m -65.28 -43.58 90.74 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.573 -0.704 . . . . 0.0 111.519 172.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -66.05 -51.82 54.71 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.997 -1.064 . . . . 0.0 111.36 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 4.2 pp -61.72 -23.13 65.94 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -82.96 -33.26 26.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 119.284 -0.388 . . . . 0.0 112.021 172.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.64 -27.38 29.16 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 114.49 1.293 . . . . 0.0 114.49 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.01 -42.43 85.29 Favored Pre-proline 0 N--CA 1.481 1.079 0 CA-C-N 120.599 1.545 . . . . 0.0 113.495 176.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -73.39 -35.07 5.23 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 CA-C-N 122.438 1.906 . . . . 0.0 113.476 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -66.69 -32.12 73.23 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.261 -1.525 . . . . 0.0 113.42 -176.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.26 -29.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 O-C-N 121.721 -0.612 . . . . 0.0 112.122 172.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 47.7 mt -71.26 -49.42 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 123.47 0.708 . . . . 0.0 110.151 172.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -57.56 -41.69 81.52 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.426 0.69 . . . . 0.0 111.995 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -67.94 -34.67 77.04 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 118.986 0.812 . . . . 0.0 112.295 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.14 -44.62 68.48 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.263 -0.898 . . . . 0.0 112.413 178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.88 -29.29 65.35 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 120.446 1.475 . . . . 0.0 114.865 179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -76.38 -27.44 56.39 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 170.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -132.97 73.05 76.09 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.019 1.328 . . . . 0.0 111.636 172.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -59.22 -11.57 13.53 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.037 3.158 . . . . 0.0 116.279 -177.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.2 pm0 -81.37 -23.19 37.85 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.78 1.632 . . . . 0.0 113.916 -176.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -65.33 157.54 28.87 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.831 1.252 . . . . 0.0 111.279 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -96.07 133.61 40.12 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 118.322 -0.847 . . . . 0.0 109.289 176.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 60.8 tp -50.62 -38.52 46.43 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -168.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . . . . . . . . 0.273 4.8 m-85 -82.33 -1.02 48.36 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -177.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 62.4 p -64.99 -32.15 73.73 Favored 'General case' 0 N--CA 1.483 1.214 0 O-C-N 120.582 -1.324 . . . . 0.0 110.925 167.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.6 m-30 -69.73 -1.87 10.33 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.415 1.486 . . . . 0.0 113.649 -176.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -77.7 -38.7 46.82 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.84 1.656 . . . . 0.0 112.244 167.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -70.02 -27.62 64.82 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -167.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -70.28 -29.2 65.9 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.018 1.727 . . . . 0.0 114.581 170.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -102.89 -45.96 4.82 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -167.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 47.9 m 46.61 40.74 8.9 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -84.17 5.41 26.44 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -172.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -80.52 24.26 0.47 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.421 1.888 . . . . 0.0 114.695 -172.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -160.7 149.7 13.65 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.271 2.229 . . . . 0.0 110.105 171.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -70.73 160.84 48.1 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.536 2.824 . . . . 0.0 112.478 174.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 44.0 t30 . . . . . 0 C--O 1.254 1.307 0 C-N-CA 125.751 1.62 . . . . 0.0 111.239 178.913 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.105 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.321 9.2 t-20 69.87 34.05 2.69 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 172.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -74.67 158.38 33.72 Favored 'General case' 0 N--CA 1.445 -0.679 0 C-N-CA 126.951 2.1 . . . . 0.0 106.226 163.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.8 t -99.37 92.69 5.53 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 124.699 1.2 . . . . 0.0 113.073 -165.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.13 -31.28 67.03 Favored 'General case' 0 CA--C 1.55 0.974 0 O-C-N 120.524 -1.36 . . . . 0.0 111.359 176.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.426 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 3.2 ptpt -74.52 -10.2 59.32 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 177.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -121.03 14.78 11.52 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.049 1.339 . . . . 0.0 111.821 168.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.8 ttm -61.42 118.95 7.62 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 120.855 -1.153 . . . . 0.0 108.016 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.2 t -76.53 154.87 34.18 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 121.176 -0.953 . . . . 0.0 109.672 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.15 -32.64 74.07 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 120.455 -1.403 . . . . 0.0 113.197 -172.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tp60 -62.82 -33.77 75.91 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 170.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.3 tt0 -77.12 -37.16 54.67 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.071 1.349 . . . . 0.0 111.361 175.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -60.0 -50.15 74.88 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 121.469 -0.769 . . . . 0.0 112.353 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.8 pt -69.41 -2.84 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 124.561 1.144 . . . . 0.0 112.981 176.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -106.02 -12.11 15.91 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 125.249 1.42 . . . . 0.0 113.738 172.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.59 165.87 23.85 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.119 0.968 . . . . 0.0 110.474 170.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.509 HD21 ' HD3' ' A' ' 19' ' ' LYS . 48.8 t-20 -72.34 131.98 84.43 Favored Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 120.786 -1.196 . . . . 0.0 111.74 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -52.1 -30.67 41.67 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 124.229 3.286 . . . . 0.0 116.077 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.509 ' HD3' HD21 ' A' ' 17' ' ' ASN . 8.2 mttt -51.5 -59.28 4.43 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 126.456 1.902 . . . . 0.0 108.893 169.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.06 -8.84 59.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 178.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 78.0 mtp -61.85 -35.38 78.1 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 120.065 1.302 . . . . 0.0 111.343 169.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . 0.26 28.2 m -64.38 -54.15 40.36 Favored Pre-proline 0 N--CA 1.48 1.048 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -175.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -52.46 -39.04 75.11 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 123.493 2.796 . . . . 0.0 116.094 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.8 p -78.03 -34.56 19.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.61 1.095 . . . . 0.0 113.491 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.43 -24.67 67.93 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.334 1.053 . . . . 0.0 110.62 172.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.516 ' CZ3' ' CD1' ' A' ' 27' ' ' TRP . 68.7 t90 -85.74 -56.46 3.48 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-O 117.939 -1.029 . . . . 0.0 112.612 168.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.516 ' CD1' ' CZ3' ' A' ' 26' ' ' TRP . 1.6 t90 -64.88 -28.99 69.92 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 120.655 1.571 . . . . 0.0 112.759 -166.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.6 tmm? -61.42 -52.12 65.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.338 1.055 . . . . 0.0 111.357 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.12 -26.58 65.87 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.839 1.656 . . . . 0.0 111.955 -175.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -111.28 6.33 20.47 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 62.13 144.74 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 128.285 2.634 . . . . 0.0 117.019 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -76.3 -3.74 38.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.1 p -87.06 -98.95 0.08 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.718 1.207 . . . . 0.0 112.206 -170.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -158.54 147.24 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 125.063 1.345 . . . . 0.0 109.357 -171.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -82.04 31.96 0.38 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 116.107 1.892 . . . . 0.0 116.107 -168.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt 59.33 17.91 6.25 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.234 1.814 . . . . 0.0 115.022 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.19 -0.33 88.79 Favored Glycine 0 CA--C 1.54 1.601 0 C-N-CA 125.478 1.513 . . . . 0.0 114.991 -173.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.38 171.57 55.14 Favored Glycine 0 CA--C 1.537 1.44 0 CA-C-N 119.091 1.446 . . . . 0.0 112.817 169.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -119.67 -23.9 6.39 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 115.368 1.618 . . . . 0.0 115.368 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . 0.28 5.8 t -82.84 54.48 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 123.043 1.402 . . . . 0.0 112.896 -171.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 35.8 m -63.06 -12.87 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 124.702 1.201 . . . . 0.0 112.481 170.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.05 144.8 27.65 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 126.276 1.831 . . . . 0.0 112.532 174.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 29.4 mt -84.32 151.59 24.65 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 122.441 1.115 . . . . 0.0 112.749 -177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -143.51 168.74 19.14 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.547 2.339 . . . . 0.0 109.214 -168.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.96 -24.02 66.72 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.683 0.994 . . . . 0.0 113.683 -169.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.4 m -63.63 -48.15 78.47 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.35 0.977 . . . . 0.0 110.569 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -64.35 -41.68 96.63 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 121.412 -0.805 . . . . 0.0 110.973 179.563 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 65.2 mt -65.11 -24.01 67.31 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.778 -0.576 . . . . 0.0 112.541 175.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 65.9 m -80.01 -33.4 39.3 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.922 1.289 . . . . 0.0 111.319 172.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 27.4 mm100 -82.64 -30.33 29.44 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.729 1.149 . . . . 0.0 113.249 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.7 -41.84 85.98 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 120.277 1.399 . . . . 0.0 113.423 175.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.1 -36.58 7.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 CA-C-N 122.392 1.89 . . . . 0.0 113.429 169.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 50.8 mmtt -66.17 -35.15 79.7 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 120.778 1.626 . . . . 0.0 113.817 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.03 -17.45 22.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 174.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 28.4 mt -88.68 -52.09 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.255 1.022 . . . . 0.0 110.904 172.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -54.91 -42.17 71.88 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.082 0.953 . . . . 0.0 110.947 176.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -67.15 -30.7 70.76 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 122.049 -0.407 . . . . 0.0 111.403 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.9 m -74.68 -45.12 46.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.101 -0.952 . . . . 0.0 113.199 174.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -30.8 69.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 120.883 1.674 . . . . 0.0 114.166 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.5 pttt -82.2 -26.55 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 176.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -130.75 75.02 79.42 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 125.606 1.563 . . . . 0.0 110.912 170.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -60.75 -11.28 16.95 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 124.799 3.666 . . . . 0.0 115.871 -179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -80.28 -25.37 39.46 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.832 1.653 . . . . 0.0 112.782 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -69.96 160.51 31.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.43 1.492 . . . . 0.0 111.955 -172.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -85.62 146.92 26.64 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.561 -0.712 . . . . 0.0 110.058 172.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 57.1 tp -61.97 -31.63 72.0 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.263 -0.898 . . . . 0.0 113.219 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 2.4 m-85 -89.62 -24.87 21.56 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 116.204 1.927 . . . . 0.0 116.204 -171.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.1 t -63.02 -15.43 56.43 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 120.863 -1.148 . . . . 0.0 112.071 171.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -66.26 -5.89 11.95 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 119.513 -1.992 . . . . 0.0 113.743 169.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -34.51 60.57 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.44 1.496 . . . . 0.0 111.606 167.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -62.96 -25.13 68.21 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.176 1.79 . . . . 0.0 112.774 -170.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -85.08 -30.89 23.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 126.423 1.889 . . . . 0.0 115.955 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.19 -52.39 5.09 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 115.382 1.623 . . . . 0.0 115.382 -166.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 42.2 m 44.9 30.42 0.56 Allowed 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 117.604 2.446 . . . . 0.0 117.604 -179.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -85.22 -9.5 57.7 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.87 1.268 . . . . 0.0 114.089 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -94.58 39.4 1.09 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.812 3.245 . . . . 0.0 116.054 -167.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.22 152.82 19.03 Favored Pre-proline 0 CA--C 1.547 0.838 0 O-C-N 121.481 -0.762 . . . . 0.0 113.014 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo -66.01 160.63 43.48 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.93 2.42 . . . . 0.0 111.876 168.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.28 0 C-N-CA 125.478 1.511 . . . . 0.0 113.518 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.944 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 58.9 t-20 68.09 -69.1 0.15 Allowed 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 128.917 2.887 . . . . 0.0 111.881 -178.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.258 50.1 mm-40 58.22 -26.77 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 117.003 2.223 . . . . 0.0 117.003 -175.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t 101.42 93.97 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 131.14 3.776 . . . . 0.0 115.008 169.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.14 -34.17 69.97 Favored 'General case' 0 CA--C 1.555 1.136 0 O-C-N 120.383 -1.448 . . . . 0.0 110.641 169.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.452 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 15.5 mtmt -58.4 -34.75 71.09 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 126.3 1.84 . . . . 0.0 114.538 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -105.44 8.73 33.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.914 1.285 . . . . 0.0 112.976 -178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 36.9 ttm -62.38 123.79 19.2 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.635 1.107 . . . . 0.0 109.662 171.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -76.32 154.7 34.83 Favored 'General case' 0 N--CA 1.48 1.075 0 O-C-N 121.015 -1.053 . . . . 0.0 110.307 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.4 m -63.38 -31.95 73.24 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 120.162 -1.586 . . . . 0.0 113.187 -173.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.7 tp60 -65.29 -32.49 74.17 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 119.155 0.889 . . . . 0.0 112.933 172.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -77.85 -37.35 48.58 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.303 1.441 . . . . 0.0 111.298 176.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -62.83 -47.69 82.33 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 121.547 -0.72 . . . . 0.0 112.75 176.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.8 pt -69.76 -3.53 3.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -104.49 -10.61 17.54 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 126.043 1.737 . . . . 0.0 114.251 170.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.69 160.42 32.66 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 119.895 1.225 . . . . 0.0 110.895 173.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.428 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 50.3 t-20 -65.72 129.96 94.43 Favored Pre-proline 0 N--CA 1.48 1.062 0 O-C-N 121.118 -0.989 . . . . 0.0 111.571 -178.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 31.9 Cg_exo -60.43 -17.38 47.39 Favored 'Trans proline' 0 CA--C 1.546 1.091 0 C-N-CA 123.278 2.652 . . . . 0.0 114.783 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 mptt -54.69 -69.39 0.13 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.501 1.52 . . . . 0.0 109.889 168.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . 0.427 ' O ' HG23 ' B' ' 103' ' ' VAL . . . -78.87 -11.53 60.0 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -175.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 16.9 ttm -54.58 -35.5 63.39 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 120.618 -1.302 . . . . 0.0 112.532 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 32.4 m -61.87 -57.8 21.93 Favored Pre-proline 0 N--CA 1.483 1.208 0 CA-C-O 117.719 -1.134 . . . . 0.0 113.542 177.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -53.95 -37.1 85.68 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.97 3.114 . . . . 0.0 114.244 169.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 99' ' ' ALA . 55.9 t -62.71 -50.14 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 121.562 -0.711 . . . . 0.0 111.534 174.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.11 -40.28 95.87 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.185 0.994 . . . . 0.0 109.897 -176.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.489 ' CZ3' ' CZ3' ' A' ' 26' ' ' TRP . 75.1 t90 -68.36 -49.65 58.76 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 116.991 -1.481 . . . . 0.0 112.592 172.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.85 -26.41 65.13 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 121.416 1.916 . . . . 0.0 111.268 -170.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 17.4 tmm? -63.29 -48.83 76.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.385 1.074 . . . . 0.0 111.045 169.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.16 -31.67 72.97 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.865 1.266 . . . . 0.0 112.172 -179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -117.35 63.91 0.73 Allowed 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.643 1.577 . . . . 0.0 111.971 171.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -54.1 -42.04 68.93 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.047 1.339 . . . . 0.0 114.613 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -64.14 125.56 24.91 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.891 0.853 . . . . 0.0 111.915 -171.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 38.0 p -69.42 -4.08 17.02 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 114.509 1.3 . . . . 0.0 114.509 -175.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -133.59 147.16 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.313 1.045 . . . . 0.0 111.898 170.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -111.99 147.9 34.95 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.979 1.312 . . . . 0.0 112.781 -169.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 38.7 mtmt -131.48 160.56 34.82 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.903 1.681 . . . . 0.0 112.419 -170.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.08 28.67 67.98 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 123.943 0.782 . . . . 0.0 113.576 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 107.42 -155.35 16.34 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.721 1.629 . . . . 0.0 111.822 -169.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -119.0 26.91 9.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.118 1.367 . . . . 0.0 113.805 -178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 11.5 p -72.35 42.97 0.1 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.953 2.101 . . . . 0.0 115.015 -173.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 19.4 m -62.16 -13.45 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.629 1.172 . . . . 0.0 112.447 168.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.22 136.69 11.75 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.912 1.685 . . . . 0.0 110.734 169.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 8.6 mp -75.01 113.92 12.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.472 0.653 . . . . 0.0 110.414 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -76.86 168.18 20.53 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.777 1.631 . . . . 0.0 109.35 171.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -63.02 -26.84 69.04 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.561 -1.337 . . . . 0.0 112.376 -179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 99.1 m -63.39 -45.4 91.26 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 121.419 -0.801 . . . . 0.0 111.493 168.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -64.38 -46.37 83.63 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 119.662 1.119 . . . . 0.0 110.265 178.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -59.31 -30.43 68.33 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.767 0.827 . . . . 0.0 112.423 175.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 86.8 m -78.75 -36.89 42.45 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.426 1.09 . . . . 0.0 111.625 174.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -78.66 -32.65 47.28 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.947 -1.095 . . . . 0.0 113.741 -176.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.6 mp -52.41 -45.24 95.26 Favored Pre-proline 0 N--CA 1.481 1.087 0 CA-C-N 120.364 1.438 . . . . 0.0 113.09 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.69 -34.99 8.31 Favored 'Trans proline' 0 C--N 1.351 0.673 0 CA-C-N 122.228 1.831 . . . . 0.0 113.277 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -66.19 -32.78 74.42 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 120.329 -1.482 . . . . 0.0 113.983 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 23.0 m -71.59 -27.19 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 121.798 -0.564 . . . . 0.0 111.878 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 51.0 mt -72.3 -47.29 53.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 123.463 0.705 . . . . 0.0 110.131 170.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -57.88 -41.06 81.73 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.697 0.799 . . . . 0.0 112.075 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -64.73 -32.35 74.0 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 119.279 0.945 . . . . 0.0 112.263 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.37 -47.4 56.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.876 -1.14 . . . . 0.0 112.428 176.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.85 -29.02 66.17 Favored 'General case' 0 N--CA 1.482 1.136 0 CA-C-N 120.555 1.525 . . . . 0.0 114.804 -178.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -74.41 -28.53 61.11 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 170.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -134.21 73.91 68.63 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 125.073 1.349 . . . . 0.0 111.71 173.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_exo -59.93 -11.11 14.02 Favored 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 124.018 3.145 . . . . 0.0 116.033 -176.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 18.7 pm0 -81.0 -22.63 39.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.929 1.692 . . . . 0.0 114.175 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -63.89 155.47 30.59 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.237 1.415 . . . . 0.0 111.085 -178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -91.33 133.73 35.19 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 171.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 61.8 tp -51.07 -39.01 55.05 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.189 1.551 . . . . 0.0 115.189 -168.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.452 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 3.7 m-85 -81.43 -5.54 58.01 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -176.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 77.0 p -59.22 -27.44 65.75 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.378 -1.451 . . . . 0.0 111.163 167.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -72.48 -2.48 19.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.209 1.404 . . . . 0.0 113.666 177.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -80.31 -32.06 38.06 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 119.747 1.158 . . . . 0.0 111.748 167.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -64.34 -26.62 68.56 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.201 1.0 . . . . 0.0 112.738 -169.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -77.01 -27.76 54.74 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 127.385 2.274 . . . . 0.0 116.149 170.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -103.22 113.47 26.98 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.966 1.469 . . . . 0.0 114.966 -166.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 31.1 m -121.03 37.59 4.28 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 125.364 1.466 . . . . 0.0 113.465 -177.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -74.84 147.93 40.69 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -171.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 26.4 t70 60.04 -54.76 0.07 Allowed 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 130.253 3.421 . . . . 0.0 118.137 170.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.06 150.59 74.94 Favored Pre-proline 0 CA--C 1.553 1.069 0 C-N-CA 124.432 1.093 . . . . 0.0 113.167 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -73.59 155.18 49.97 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.517 2.811 . . . . 0.0 112.487 175.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.244 0 C-N-CA 126.006 1.723 . . . . 0.0 110.986 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.892 0 N-CA-C 112.289 0.478 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.4 t30 56.35 47.88 18.17 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.069 1.748 . . . . 0.0 115.034 176.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -62.71 -21.17 65.57 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 118.249 -0.882 . . . . 0.0 111.995 167.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.7 t 98.59 91.58 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 128.72 2.808 . . . . 0.0 117.361 164.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.9 -34.89 73.78 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 119.88 -1.763 . . . . 0.0 112.091 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' CD1' ' A' ' 67' ' ' TYR . 4.9 ptpt -72.12 -4.42 28.93 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.494 1.665 . . . . 0.0 115.494 175.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.65 5.15 11.04 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.501 1.52 . . . . 0.0 112.445 169.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 31.3 ttm -62.56 125.67 24.73 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 120.641 -1.287 . . . . 0.0 109.54 175.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 14.7 t -78.71 154.79 29.8 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.402 -0.811 . . . . 0.0 110.496 179.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -62.03 -34.11 75.61 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.413 -1.429 . . . . 0.0 113.083 -175.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -63.49 -31.86 73.15 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.715 0.806 . . . . 0.0 112.871 172.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -78.44 -38.13 42.04 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.958 1.303 . . . . 0.0 111.697 174.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.1 t80 -58.81 -50.03 75.47 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.533 0.733 . . . . 0.0 112.452 177.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.0 pt -67.86 -7.18 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.43 1.092 . . . . 0.0 112.98 177.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -106.51 -7.95 17.28 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.85 1.66 . . . . 0.0 113.607 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.23 159.29 32.7 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 110.702 175.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 51.9 t-20 -64.93 128.87 94.16 Favored Pre-proline 0 N--CA 1.483 1.184 0 O-C-N 121.222 -0.924 . . . . 0.0 112.088 -173.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 17' ' ' ASN . 31.2 Cg_exo -56.91 -16.58 20.82 Favored 'Trans proline' 0 CA--C 1.545 1.033 0 C-N-CA 123.838 3.026 . . . . 0.0 115.247 178.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.3 mttt -61.71 -69.71 0.23 Allowed 'General case' 0 C--N 1.348 0.524 0 C-N-CA 125.819 1.648 . . . . 0.0 110.15 167.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.28 -3.12 48.09 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.5 ttt -58.91 -36.65 75.07 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 169.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.5 m -65.43 -51.5 51.55 Favored Pre-proline 0 N--CA 1.482 1.152 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.422 ' HA ' ' CE3' ' B' ' 106' ' ' TRP . 5.8 Cg_endo -51.55 -47.71 24.87 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 123.048 2.499 . . . . 0.0 114.904 169.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 p -67.36 -37.53 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.788 -1.195 . . . . 0.0 113.162 177.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.46 -17.34 63.74 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.158 0.983 . . . . 0.0 112.854 175.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.467 ' CZ3' ' CZ3' ' B' ' 105' ' ' TRP . 43.7 t90 -97.97 -45.24 6.35 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 119.922 1.237 . . . . 0.0 111.814 168.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.506 ' CH2' ' CG ' ' B' ' 105' ' ' TRP . 31.5 t-105 -59.33 -34.29 72.16 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.108 0.963 . . . . 0.0 111.456 -172.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 17.8 tmm? -74.13 -51.6 15.13 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 125.787 1.635 . . . . 0.0 112.453 169.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -71.01 -39.35 72.44 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -168.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.44 ' CG ' HD22 ' A' ' 75' ' ' ASN . 0.9 OUTLIER -85.93 -40.67 15.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.669 0.668 . . . . 0.0 111.765 172.21 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 73.71 116.79 0.05 Allowed 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.827 2.451 . . . . 0.0 114.094 -176.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.88 102.14 7.14 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 169.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.1 t -145.85 39.85 1.15 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.209 1.404 . . . . 0.0 110.35 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 62.0 t 61.78 153.28 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 127.878 2.471 . . . . 0.0 111.697 -167.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . 0.295 2.1 t80 -101.57 18.03 21.3 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.259 2.318 . . . . 0.0 117.259 -168.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.39 37.74 9.32 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.931 1.692 . . . . 0.0 114.749 169.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 76.48 3.45 77.87 Favored Glycine 0 CA--C 1.546 1.992 0 C-N-CA 125.767 1.651 . . . . 0.0 116.506 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.57 -173.41 49.7 Favored Glycine 0 CA--C 1.539 1.582 0 CA-C-N 119.492 1.646 . . . . 0.0 114.272 177.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -129.96 -14.77 3.92 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 29.7 p -77.62 36.52 0.21 Allowed 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.294 1.59 . . . . 0.0 115.294 -173.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 30.5 m -60.94 -16.98 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 112.17 169.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.58 155.38 0.16 Allowed 'General case' 0 C--O 1.236 0.359 0 C-N-CA 127.921 2.488 . . . . 0.0 113.289 169.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.4 tp -77.59 79.11 4.1 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 167.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -67.18 170.16 7.48 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.896 1.278 . . . . 0.0 112.503 -173.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -64.04 -30.86 71.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 120.411 -1.43 . . . . 0.0 112.926 -178.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.8 m -62.06 -47.43 84.73 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.56 -0.713 . . . . 0.0 110.645 168.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -62.9 -43.71 98.07 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.543 -0.723 . . . . 0.0 110.791 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.52 -27.42 69.14 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.806 -1.184 . . . . 0.0 112.185 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 90.8 m -76.06 -36.79 58.88 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.569 0.747 . . . . 0.0 111.45 170.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -84.56 -27.6 27.2 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -176.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -52.25 -42.17 85.2 Favored Pre-proline 0 CA--C 1.55 0.949 0 CA-C-N 120.235 1.38 . . . . 0.0 112.918 175.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -71.47 -37.46 5.56 Favored 'Trans proline' 0 C--N 1.352 0.756 0 CA-C-N 122.145 1.802 . . . . 0.0 113.02 169.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -67.84 -33.09 74.09 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 120.226 -1.546 . . . . 0.0 113.76 -175.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.6 m -68.21 -17.27 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 118.908 0.776 . . . . 0.0 113.083 173.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.2 mt -87.43 -52.1 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.72 1.208 . . . . 0.0 110.186 172.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -56.67 -40.33 75.36 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.423 1.089 . . . . 0.0 111.838 176.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -71.96 -24.88 61.67 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.552 -0.717 . . . . 0.0 111.12 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.95 -43.69 21.63 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.318 -0.864 . . . . 0.0 112.193 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -27.78 69.53 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 120.444 1.475 . . . . 0.0 113.586 172.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -71.59 -37.7 70.96 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 169.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -125.22 63.53 42.64 Favored Pre-proline 0 CA--C 1.544 0.735 0 C-N-CA 125.001 1.32 . . . . 0.0 111.353 -176.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -58.17 -13.48 16.07 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 124.189 3.259 . . . . 0.0 115.905 -173.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -86.1 -21.12 27.82 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.765 1.626 . . . . 0.0 113.581 -178.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -70.26 160.18 32.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.933 0.893 . . . . 0.0 112.008 -172.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -94.58 132.05 39.7 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 177.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -50.03 -36.61 29.53 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 -169.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.437 ' CD1' ' HA ' ' A' ' 6' ' ' LYS . 3.5 m-85 -80.52 -9.33 59.77 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.795 -1.19 . . . . 0.0 114.06 -176.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 72.0 p -60.68 -26.83 67.39 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.646 -1.284 . . . . 0.0 111.348 168.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 6.0 m-30 -71.88 -2.47 18.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.348 1.459 . . . . 0.0 114.274 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 -31.77 24.47 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.815 1.189 . . . . 0.0 111.678 168.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -71.78 -28.11 63.4 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.889 1.276 . . . . 0.0 111.87 -171.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -69.98 -30.19 67.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.75 1.22 . . . . 0.0 114.008 171.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.68 -44.15 6.54 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 115.576 1.695 . . . . 0.0 115.576 -167.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 48.0 m 62.06 -39.42 0.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 127.689 2.396 . . . . 0.0 115.479 -168.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.44 HD22 ' CG ' ' A' ' 30' ' ' HIS 0.283 2.3 t30 67.4 179.7 0.22 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 129.522 3.129 . . . . 0.0 116.305 172.476 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -70.83 -1.78 12.78 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 118.385 2.735 . . . . 0.0 118.385 -165.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.91 147.98 97.92 Favored Pre-proline 0 CA--C 1.555 1.139 0 CA-C-N 119.841 1.2 . . . . 0.0 112.788 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -63.76 161.17 33.47 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 122.775 2.317 . . . . 0.0 113.717 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.892 1.677 . . . . 0.0 113.951 -179.011 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.847 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 57.45 50.69 10.86 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 125.935 1.694 . . . . 0.0 114.26 176.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -65.85 -20.04 66.09 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 117.829 -1.081 . . . . 0.0 113.088 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 61.1 m 107.51 84.06 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 129.857 3.263 . . . . 0.0 115.761 167.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.09 -39.29 69.16 Favored 'General case' 0 CA--C 1.552 1.03 0 O-C-N 120.243 -1.536 . . . . 0.0 111.751 175.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.453 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 8.3 ptpt -77.7 3.03 15.02 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 175.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -125.9 7.97 7.42 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.942 1.297 . . . . 0.0 112.194 169.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 34.5 ttm -62.71 125.04 22.6 Favored 'General case' 0 C--N 1.346 0.457 0 O-C-N 121.048 -1.032 . . . . 0.0 109.597 176.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 14.4 t -77.63 153.15 33.44 Favored 'General case' 0 N--CA 1.476 0.854 0 O-C-N 121.81 -0.556 . . . . 0.0 110.1 -179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.05 -30.62 71.68 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 120.475 -1.391 . . . . 0.0 112.978 -173.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.5 tp60 -64.67 -31.67 73.0 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.857 0.753 . . . . 0.0 112.847 170.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 61.3 tt0 -78.53 -38.39 40.65 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 124.854 1.261 . . . . 0.0 111.414 174.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -59.7 -48.15 82.83 Favored 'General case' 0 N--CA 1.463 0.223 0 O-C-N 121.541 -0.724 . . . . 0.0 112.728 177.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 5.6 pt -69.57 -2.28 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.961 0.904 . . . . 0.0 113.116 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -109.31 -12.68 14.73 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.282 1.833 . . . . 0.0 114.112 173.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.85 157.78 35.81 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 119.944 1.247 . . . . 0.0 111.032 172.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.403 HD21 ' HD2' ' B' ' 98' ' ' LYS . 51.9 t-20 -66.59 130.21 94.1 Favored Pre-proline 0 N--CA 1.483 1.178 0 O-C-N 121.462 -0.774 . . . . 0.0 111.614 -175.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -57.82 -18.3 33.75 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.562 2.841 . . . . 0.0 115.188 177.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . 0.403 ' HD2' HD21 ' B' ' 96' ' ' ASN . 33.8 mttt -58.5 -68.69 0.23 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 126.07 1.748 . . . . 0.0 109.512 167.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.31 -2.49 49.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 -177.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 27.9 ttm -61.92 -36.99 82.98 Favored 'General case' 0 N--CA 1.478 0.962 0 O-C-N 120.71 -1.243 . . . . 0.0 111.811 168.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 49.8 m -63.88 -52.26 58.38 Favored Pre-proline 0 N--CA 1.483 1.202 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.827 -177.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . 0.405 ' HB3' ' CD1' ' A' ' 27' ' ' TRP . 3.1 Cg_exo -47.8 -49.56 13.4 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 124.303 3.335 . . . . 0.0 114.932 169.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.91 -33.9 53.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 119.201 0.909 . . . . 0.0 113.205 178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -25.13 67.95 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.807 0.843 . . . . 0.0 112.007 173.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' B' ' 106' ' ' TRP . 70.2 t90 -83.55 -55.85 4.06 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.078 165.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' B' ' 105' ' ' TRP . 1.4 t90 -62.62 -34.45 77.05 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 117.534 -1.666 . . . . 0.0 114.108 -162.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.9 tmm? -64.74 -43.29 93.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.15 0.98 . . . . 0.0 111.601 175.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.49 -31.19 65.18 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.209 1.804 . . . . 0.0 111.739 -177.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -146.74 91.74 2.06 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 126.576 1.95 . . . . 0.0 108.946 -172.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.11 163.39 26.66 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.328 1.603 . . . . 0.0 115.328 -169.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.73 12.97 0.31 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.937 1.458 . . . . 0.0 114.937 171.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 25.2 p -70.9 30.87 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 126.892 2.077 . . . . 0.0 115.873 -172.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 64.3 t 65.9 120.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 130.054 3.342 . . . . 0.0 113.044 178.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -80.56 142.4 34.14 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.999 -168.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 6.9 ptpt -130.87 -11.37 3.82 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 -168.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . -84.46 -8.0 83.86 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.135 0.874 . . . . 0.0 114.168 171.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 147.47 -133.89 4.92 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.992 1.758 . . . . 0.0 110.692 -173.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -124.55 6.27 8.26 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.008 1.723 . . . . 0.0 113.781 174.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 8.2 p -80.29 60.7 3.83 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.249 2.22 . . . . 0.0 112.526 -175.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 31.4 m -67.78 5.6 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.275 1.03 . . . . 0.0 113.742 169.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -49.36 149.73 2.09 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 128.171 2.588 . . . . 0.0 113.721 171.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.89 114.08 5.44 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 168.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -79.42 168.53 19.36 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.235 1.014 . . . . 0.0 109.69 172.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.69 -25.67 68.31 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.483 -1.386 . . . . 0.0 111.767 173.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 25.1 m -64.38 -44.01 92.7 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 118.501 -0.761 . . . . 0.0 111.122 169.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -61.14 -50.75 71.93 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 119.812 1.187 . . . . 0.0 110.107 174.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 88.8 mt -57.48 -29.49 64.31 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.615 0.766 . . . . 0.0 112.476 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.9 m -81.21 -36.1 30.48 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.475 1.11 . . . . 0.0 112.161 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 22.1 mm100 -83.48 -29.39 28.03 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.975 1.102 . . . . 0.0 113.975 -176.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.88 -41.34 78.48 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 120.163 1.347 . . . . 0.0 113.365 176.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -74.15 -36.43 3.33 Favored 'Trans proline' 0 C--N 1.354 0.86 0 CA-C-N 122.257 1.842 . . . . 0.0 113.613 169.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -66.81 -30.44 70.63 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 120.398 -1.439 . . . . 0.0 114.092 -175.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 30.4 m -69.09 -22.19 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 172.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 28.3 mt -79.2 -50.98 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.258 1.023 . . . . 0.0 109.581 170.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -59.05 -38.55 79.64 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 179.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -69.11 -29.98 68.17 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.002 0.819 . . . . 0.0 112.227 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.88 -47.58 44.77 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.168 -0.957 . . . . 0.0 112.505 177.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.75 -28.27 67.49 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 120.333 1.424 . . . . 0.0 114.472 -179.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -77.29 -24.68 50.93 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.051 1.501 . . . . 0.0 115.051 171.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -135.08 72.79 66.69 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.807 1.243 . . . . 0.0 111.892 172.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -59.76 -12.16 17.16 Favored 'Trans proline' 0 C--N 1.355 0.875 0 C-N-CA 123.804 3.003 . . . . 0.0 117.182 -173.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.71 -20.6 39.08 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.6 1.16 . . . . 0.0 113.486 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 52.0 mmtt -65.8 157.55 30.06 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.845 0.858 . . . . 0.0 112.135 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 28.2 t30 -93.07 131.47 38.06 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 174.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 58.2 tp -47.66 -39.02 16.15 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.385 1.474 . . . . 0.0 114.685 -172.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.453 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.4 m-85 -79.72 -8.79 59.45 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -176.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 68.4 p -60.46 -26.7 66.97 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 120.596 -1.315 . . . . 0.0 110.976 167.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -73.41 -2.22 21.47 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.18 1.392 . . . . 0.0 113.53 177.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -81.72 -32.87 31.39 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 119.688 1.131 . . . . 0.0 111.783 167.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -67.27 -31.12 71.22 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.539 1.136 . . . . 0.0 112.269 -169.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -70.38 -28.05 64.8 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.592 1.957 . . . . 0.0 115.502 172.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -105.08 98.07 7.83 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.596 1.702 . . . . 0.0 115.596 -166.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 38.2 p -83.37 59.35 4.99 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.893 1.677 . . . . 0.0 111.272 169.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -72.53 96.12 1.9 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 125.568 1.547 . . . . 0.0 113.659 -168.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 15.3 t70 61.79 -40.92 0.14 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 129.617 3.167 . . . . 0.0 118.021 172.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 4.5 pp -67.16 152.61 95.9 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 125.073 1.349 . . . . 0.0 112.85 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -55.48 131.91 49.04 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.599 2.866 . . . . 0.0 113.703 179.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.708 1.603 . . . . 0.0 111.648 -172.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . 0.277 14.3 t-20 68.08 69.91 0.33 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.965 1.84 . . . . 0.0 112.668 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -119.09 154.22 33.55 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 130.075 3.35 . . . . 0.0 102.929 166.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.6 m -94.77 89.58 5.75 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 124.562 1.145 . . . . 0.0 112.345 -163.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.76 -32.17 65.34 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 120.008 1.277 . . . . 0.0 111.014 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' CG ' ' A' ' 67' ' ' TYR . 10.2 mtmt -62.96 -20.72 65.52 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 127.16 2.184 . . . . 0.0 115.018 175.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -121.67 16.2 11.1 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.774 1.63 . . . . 0.0 111.778 177.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 56.3 ttm -61.77 117.73 6.23 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 169.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 15.3 t -75.53 155.04 36.48 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.162 -0.961 . . . . 0.0 109.499 -179.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 m -63.18 -32.81 74.3 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 120.303 -1.498 . . . . 0.0 112.787 -172.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -62.84 -35.2 79.16 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 170.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -75.41 -37.88 60.21 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.826 1.251 . . . . 0.0 111.479 174.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -60.18 -50.69 72.67 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.531 -0.731 . . . . 0.0 112.241 177.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.5 pt -69.52 -1.19 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.547 1.139 . . . . 0.0 112.958 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -110.85 -10.87 14.41 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.728 1.611 . . . . 0.0 113.972 173.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.7 164.92 22.4 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 120.962 -1.086 . . . . 0.0 110.255 169.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 54.3 t-20 -64.77 128.04 93.19 Favored Pre-proline 0 CA--C 1.556 1.196 0 O-C-N 120.84 -1.162 . . . . 0.0 112.219 -176.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -61.3 -7.26 8.06 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 124.788 3.658 . . . . 0.0 116.24 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' B' ' 82' ' ' GLU . 5.9 mptt -71.56 -59.29 2.83 Favored 'General case' 0 C--O 1.218 -0.568 0 C-N-CA 127.072 2.149 . . . . 0.0 109.056 165.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.13 0.22 54.09 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 115.916 1.821 . . . . 0.0 115.916 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 82.1 mtp -59.21 -36.86 76.14 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 120.84 -1.162 . . . . 0.0 112.364 169.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.7 m -65.63 -51.18 51.82 Favored Pre-proline 0 N--CA 1.483 1.189 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 -174.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -53.05 -45.62 39.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 123.179 2.586 . . . . 0.0 114.932 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.7 p -71.64 -31.88 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.605 -1.31 . . . . 0.0 113.419 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.1 -24.16 67.59 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.742 0.817 . . . . 0.0 111.485 171.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.439 ' CG ' ' CZ2' ' B' ' 106' ' ' TRP . 74.0 t90 -85.09 -53.43 5.28 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 117.779 -1.105 . . . . 0.0 112.263 167.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.424 ' CH2' ' HB3' ' B' ' 105' ' ' TRP . 0.1 OUTLIER -52.94 -34.48 55.68 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.075 0.94 . . . . 0.0 112.62 -172.679 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -69.62 -49.14 56.69 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 124.676 1.19 . . . . 0.0 112.259 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.95 -38.15 85.59 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.79 1.636 . . . . 0.0 111.813 -176.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -123.78 94.22 4.17 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.826 1.651 . . . . 0.0 110.409 170.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.68 152.66 38.46 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.813 0.845 . . . . 0.0 112.637 -176.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -74.98 23.68 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.066 1.346 . . . . 0.0 114.29 -171.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 61.6 p -75.8 27.8 0.11 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.024 2.13 . . . . 0.0 113.596 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 71.9 t 61.8 147.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 129.408 3.083 . . . . 0.0 114.387 -175.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.26 139.09 40.98 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 120.846 -1.159 . . . . 0.0 112.412 -177.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.5 ptpt -152.95 153.26 32.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.423 1.489 . . . . 0.0 112.275 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.12 13.53 64.69 Favored Glycine 0 CA--C 1.542 1.726 0 C-N-CA 124.121 0.867 . . . . 0.0 114.449 -175.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.41 178.23 32.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.869 2.176 . . . . 0.0 111.397 -170.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -134.04 4.82 3.54 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 m -83.0 69.95 9.91 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.596 -1.315 . . . . 0.0 111.658 -170.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 4.2 t -58.58 -29.51 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 125.708 1.603 . . . . 0.0 112.507 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.51 154.71 3.37 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.228 1.811 . . . . 0.0 113.164 169.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -66.19 126.19 27.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.527 -0.733 . . . . 0.0 110.435 174.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -89.57 167.19 13.15 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.484 1.914 . . . . 0.0 108.95 170.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -66.42 -28.97 69.03 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 119.874 -1.766 . . . . 0.0 113.255 -170.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.1 m -65.7 -41.96 91.73 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.443 -0.785 . . . . 0.0 110.849 168.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -63.94 -41.75 97.52 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.126 -0.984 . . . . 0.0 109.827 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -64.29 -24.99 67.85 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.08 0.952 . . . . 0.0 112.211 174.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 99.8 m -79.83 -32.19 40.6 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.46 1.104 . . . . 0.0 111.627 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -87.4 -28.7 21.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.577 1.08 . . . . 0.0 113.579 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 1.5 mp -51.39 -41.97 79.27 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-O 117.384 -1.293 . . . . 0.0 113.185 173.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.41 -36.51 6.78 Favored 'Trans proline' 0 C--N 1.355 0.91 0 CA-C-N 122.382 1.886 . . . . 0.0 113.357 169.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 49.4 mmtt -65.96 -35.62 81.08 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 120.317 -1.489 . . . . 0.0 113.565 -177.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 25.8 m -68.23 -21.43 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 174.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 29.6 mt -82.72 -51.37 14.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.901 0.88 . . . . 0.0 110.555 172.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.97 -43.21 73.3 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.043 0.937 . . . . 0.0 111.33 176.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -67.46 -30.05 69.67 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.918 -0.489 . . . . 0.0 111.732 -179.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 5.5 m -74.41 -46.03 42.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 118.182 -0.913 . . . . 0.0 113.174 173.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.22 -30.34 68.49 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.866 1.667 . . . . 0.0 114.453 177.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . 0.252 20.4 pttt -79.21 -24.73 42.91 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 175.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -135.29 74.95 60.22 Favored Pre-proline 0 CA--C 1.556 1.202 0 C-N-CA 125.323 1.449 . . . . 0.0 112.522 169.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -59.53 -11.3 13.57 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 124.523 3.482 . . . . 0.0 117.176 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -80.15 -21.99 42.52 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.063 1.345 . . . . 0.0 113.369 -179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -69.43 159.22 33.63 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.861 1.264 . . . . 0.0 111.64 -174.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -80.38 148.16 30.73 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.625 -0.672 . . . . 0.0 109.991 170.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.35 -33.55 75.76 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 121.27 -0.894 . . . . 0.0 112.666 175.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.422 ' CG ' ' HA ' ' A' ' 6' ' ' LYS . 3.7 m-85 -89.96 -24.66 21.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 117.007 2.225 . . . . 0.0 117.007 -169.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 13.8 t -60.0 -21.99 61.99 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 121.057 -1.027 . . . . 0.0 111.902 171.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -60.52 -7.44 2.14 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 119.944 -1.723 . . . . 0.0 113.709 171.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.7 tptt -66.9 -37.51 84.51 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.522 1.529 . . . . 0.0 112.258 167.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -29.88 71.03 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -167.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -85.29 -23.16 28.26 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.581 1.952 . . . . 0.0 115.848 -175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -121.74 12.18 10.58 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 118.501 2.778 . . . . 0.0 118.501 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 58.6 m -54.16 104.34 0.1 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 120.245 1.384 . . . . 0.0 113.921 -176.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -101.98 -94.61 0.29 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 125.771 1.628 . . . . 0.0 114.837 -172.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -71.66 -26.37 62.51 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 116.339 1.977 . . . . 0.0 116.339 -166.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.57 153.1 81.02 Favored Pre-proline 0 CA--C 1.548 0.871 0 N-CA-C 114.152 1.168 . . . . 0.0 114.152 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -83.06 167.59 14.06 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 123.756 2.97 . . . . 0.0 111.023 168.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.165 1.386 . . . . 0.0 112.022 177.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.009 0 N-CA-C 112.249 0.462 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' ASN . . . . . . . . . . . . . 52.9 t30 54.68 63.97 1.97 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.799 1.64 . . . . 0.0 112.98 -175.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.454 ' HB3' ' HE3' ' A' ' 19' ' ' LYS 0.25 52.9 mm-40 -66.53 -6.53 15.32 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 169.873 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 72.7 m 108.0 84.47 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 130.595 3.558 . . . . 0.0 112.334 171.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.84 67.94 Favored 'General case' 0 CA--C 1.556 1.205 0 O-C-N 120.843 -1.161 . . . . 0.0 111.219 173.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.461 ' HA ' ' CD1' ' B' ' 146' ' ' TYR . 11.9 mtmt -63.42 -16.72 61.38 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 127.232 2.213 . . . . 0.0 116.601 173.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -121.2 9.32 10.43 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.866 1.266 . . . . 0.0 112.603 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 41.4 ttm -60.93 124.1 19.5 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.391 -0.818 . . . . 0.0 109.42 175.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 15.2 t -77.46 156.04 31.34 Favored 'General case' 0 N--CA 1.481 1.085 0 O-C-N 121.634 -0.667 . . . . 0.0 110.907 -177.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 1.3 m -64.41 -32.83 74.61 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 120.133 -1.604 . . . . 0.0 113.112 -173.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 17.9 tp60 -64.78 -29.03 69.99 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.032 0.833 . . . . 0.0 112.611 171.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -84.25 -36.33 22.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.756 1.622 . . . . 0.0 111.313 178.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -62.26 -48.95 77.66 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 121.381 -0.824 . . . . 0.0 112.789 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 6.9 pt -66.69 -6.3 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 C-N-CA 123.816 0.847 . . . . 0.0 112.874 177.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -106.91 -11.57 15.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.314 1.846 . . . . 0.0 114.535 174.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.88 158.4 35.61 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 119.906 1.23 . . . . 0.0 110.845 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' ASN . . . . . 0.445 ' HA ' ' HD3' ' B' ' 97' ' ' PRO . 50.3 t-20 -66.38 131.03 94.22 Favored Pre-proline 0 N--CA 1.481 1.085 0 O-C-N 121.335 -0.853 . . . . 0.0 111.622 -176.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' B' ' 96' ' ' ASN . 35.4 Cg_exo -60.9 -18.68 58.46 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 123.125 2.55 . . . . 0.0 114.566 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -55.34 -67.82 0.25 Allowed 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.183 1.393 . . . . 0.0 109.85 168.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.02 -4.58 57.07 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -175.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' MET . . . . . . . . . . . . . 31.4 ttm -59.88 -41.04 90.69 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 121.04 -1.038 . . . . 0.0 112.032 168.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 67.5 m -56.04 -54.9 47.32 Favored Pre-proline 0 N--CA 1.484 1.229 0 CA-C-O 117.97 -1.014 . . . . 0.0 113.45 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.74 -53.82 5.04 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.02 3.147 . . . . 0.0 113.699 171.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.6 -31.91 54.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 119.448 -2.032 . . . . 0.0 113.306 -176.054 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.93 -31.96 73.16 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 118.224 -0.893 . . . . 0.0 111.186 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' TRP . . . . . 0.424 ' HB3' ' CH2' ' A' ' 27' ' ' TRP 0.288 0.0 OUTLIER -86.37 -39.23 16.63 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 116.487 -1.72 . . . . 0.0 112.322 176.261 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.439 ' CZ2' ' CG ' ' A' ' 26' ' ' TRP . 2.4 m0 -62.26 -22.13 65.75 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 122.419 2.372 . . . . 0.0 113.022 173.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -77.47 -57.84 3.6 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.981 0.912 . . . . 0.0 111.873 168.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.32 -33.62 76.39 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.671 0.788 . . . . 0.0 112.271 -172.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -112.0 60.48 0.62 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.186 1.794 . . . . 0.0 111.274 170.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -49.24 154.67 0.8 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 125.005 1.322 . . . . 0.0 112.323 169.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 67.35 -25.96 0.12 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 127.309 2.243 . . . . 0.0 114.635 -169.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' THR . . . . . . . . . . . . . 8.4 p 62.54 -34.37 0.11 Allowed 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 129.202 3.001 . . . . 0.0 117.0 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 85.5 t -71.21 122.23 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 125.919 1.688 . . . . 0.0 109.889 -177.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -88.47 156.64 18.99 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -168.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' LYS . . . . . . . . . . . . . 11.4 ptpt -149.5 146.23 27.28 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.32 1.448 . . . . 0.0 111.799 -172.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 68.4 9.04 57.25 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 115.712 1.045 . . . . 0.0 115.712 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 169.23 -161.26 34.82 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 125.65 1.595 . . . . 0.0 112.42 -174.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -135.28 11.03 3.53 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -176.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' THR . . . . . . . . . . . . . 2.5 p -78.35 46.6 0.63 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.472 1.909 . . . . 0.0 114.557 -171.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 33.7 m -64.79 -23.61 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 124.769 1.228 . . . . 0.0 112.762 169.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -52.69 141.27 21.4 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.229 1.012 . . . . 0.0 110.739 169.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 19.7 mt -47.66 108.69 0.17 Allowed 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 118.843 0.747 . . . . 0.0 111.398 170.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -79.67 164.89 23.41 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.142 1.377 . . . . 0.0 109.772 176.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -64.96 -28.66 69.67 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 120.078 -1.639 . . . . 0.0 112.467 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' THR . . . . . . . . . . . . . 88.6 m -62.82 -42.38 99.7 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 121.482 -0.762 . . . . 0.0 110.801 168.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.49 -45.67 71.72 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 121.387 -0.82 . . . . 0.0 110.572 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 91.6 mt -57.14 -28.21 62.53 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.028 0.931 . . . . 0.0 112.389 173.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' THR . . . . . . . . . . . . . 47.5 m -80.8 -36.11 32.17 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.921 0.888 . . . . 0.0 112.013 172.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -81.95 -31.4 31.26 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.758 1.163 . . . . 0.0 114.058 -177.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' ILE . . . . . . . . . . . . . 1.5 mp -53.02 -39.68 72.62 Favored Pre-proline 0 CA--C 1.552 1.039 0 CA-C-N 120.07 1.305 . . . . 0.0 113.163 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -75.15 -36.37 2.51 Favored 'Trans proline' 0 C--N 1.354 0.84 0 CA-C-N 122.388 1.889 . . . . 0.0 113.366 169.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt -66.06 -29.74 70.14 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.395 -1.441 . . . . 0.0 113.908 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' VAL . . . . . . . . . . . . . 32.3 m -69.38 -21.75 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 122.968 0.507 . . . . 0.0 112.327 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' ILE . . . . . . . . . . . . . 10.3 mt -77.68 -50.7 19.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.327 1.051 . . . . 0.0 109.697 169.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -60.42 -39.57 87.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.293 0.637 . . . . 0.0 112.516 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -69.46 -27.46 65.24 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 119.019 0.827 . . . . 0.0 112.209 177.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.11 -50.11 20.93 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.453 -0.779 . . . . 0.0 112.319 175.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.49 -27.32 68.4 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -79.05 -20.18 49.51 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 171.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -136.44 66.71 58.93 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.472 1.509 . . . . 0.0 110.52 175.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.23 -14.26 37.17 Favored 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 124.142 3.228 . . . . 0.0 116.494 -168.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -77.95 -24.72 48.07 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 55.1 mmtt -62.62 157.96 19.42 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.937 1.295 . . . . 0.0 112.302 -174.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -82.17 150.65 27.29 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.552 -0.717 . . . . 0.0 109.988 171.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.72 -41.18 99.04 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.293 -0.879 . . . . 0.0 113.15 176.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' TYR . . . . . 0.461 ' CD1' ' HA ' ' B' ' 85' ' ' LYS . 4.7 m-85 -82.41 -19.72 38.5 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -169.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' THR . . . . . . . . . . . . . 11.6 t -64.04 -15.01 58.5 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.793 -1.192 . . . . 0.0 112.197 169.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -67.87 -2.56 7.56 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 119.313 -2.117 . . . . 0.0 113.532 169.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 24.0 tptp -77.71 -30.81 51.96 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.69 1.132 . . . . 0.0 111.92 165.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -63.52 -33.38 75.45 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.919 1.288 . . . . 0.0 112.177 -169.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.94 -29.06 64.98 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.618 1.967 . . . . 0.0 115.346 170.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -98.77 105.26 17.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.408 1.483 . . . . 0.0 113.025 -168.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 78.6 p -91.87 -6.08 52.17 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 -176.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 154' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -84.2 16.95 2.7 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -169.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -72.87 1.81 7.97 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -146.38 149.91 39.21 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 128.051 2.54 . . . . 0.0 109.158 169.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 157' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.17 156.48 64.76 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 123.505 2.803 . . . . 0.0 112.664 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 158' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.252 1.189 0 C-N-CA 125.66 1.584 . . . . 0.0 110.995 179.139 . . . . . . . . 1 1 . 1 stop_ save_